C1CCN(CC1)C2(CCNCC2)C(=O)N 10004
C[N+](=C1C(CCO1)(c2ccccc2)c3ccccc3)C.[Br-] 10017
c1cc(ccc1C(c2ccc(cc2)F)N3CCNCC3)F 10018
CCOC(=O)N1CCC(CC1)N 10024
CCOC(=O)N1CCC(CC1)N 18929
CC(=C)n1c2ccccc2[nH]c1=O 10029
c1ccc2c(c1)[nH]c(=O)n2CCCCl 10030
c1cc(ccc1N2CCNCC2)O.Br.Br 10033
CC(=O)N1CCN(CC1)c2ccc(cc2)O 10034
c1cc2cccc3c2c(c1)CC3 20134
c1cc2cccc3c2c(c1)C(=O)C3=O 10219
CCOC(C)OCC 10222
C/C=N/O 10223
CC(=O)N 15363
CC(=O)NC(=C)C(=O)O 10225
Cc1c(c(=O)n(n1C)c2ccccc2)NC(=O)C 10226
CC(=O)Nc1cccc(c1)C(F)(F)F 10228
CC(=O)NCCCC(=O)O 10229
CC(=O)Nc1ccc-2c(c1)Cc3c2cccc3 10230
CC(=O)Nc1cccc(c1)O 10232
CC(=O)Nc1ccc(cc1)O 10233
CC(=O)Nc1ccc(cc1)S 10234
CC(=O)NN 10235
CC(=O)CC(=O)Nc1ccccc1 10236
CC(=O)CC(=O)Nc1ccccc1OC 10237
CC(=NO)C 10239
CC(=O)CCC(=O)C 10240
CC(=O)c1ccccc1 10241
CC(=O)c1ccc(c(c1)OC)O 10242
CC(=O)c1c2ccccc2cc3c1cccc3 10244
CC(=O)Nc1ccccc1C(=O)O 10245
CC(=O)c1ccccc1C(=O)O 10247
CC(=O)C1CCOC1=O 10249
CC(=O)C1=CCCCC1 10250
Cc1c[nH]c(c1C(=O)C)C 10251
C(#CC(=O)O)C(=O)O 10252
C(#CC(=O)[O-])C(=O)O.[K+] 10253
CC(=O)c1ccc-2c(c1)Cc3c2cccc3 10254
CC(=O)c1ccco1 10255
CC(=O)N[C@@H]1[C@H]([C@@H]([C@H](O[C@@H]1O)CO)O)O 10256
CC(=O)NCC(=O)O 10257
CC(=O)NC1CCSC1=O 10258
CC(=O)c1c[nH]c2c1cccc2 10259
CC(=O)OC(c1ccccc1)C(=O)Cl 10260
CC(=O)c1ccccn1 10268
CC(=O)c1cccnc1 10269
CC(=O)c1ccncc1 10270
CC(=O)SCC[N+](C)(C)C.[I-] 10271
CC(=O)c1cccs1 10272
CC(=O)c1cccs1 29483
CC(=O)NNC(=S)N 10273
CC(=O)NC(=S)N 10274
c1ccc2c(c1)cc3ccccc3n2 10276
c1nc(c2c(n1)n(cn2)[C@H]3[C@@H]([C@@H]([C@H](O3)COP(=O)(O)O)O)O)N 10279
C(CCC(=O)O)CC(=O)O 10281
COC(=O)CCCCC(=O)O 10282
C[C@@H](C(=O)O)N 10283
C1(C(=O)NC(=O)N1)NC(=O)N 10284
C=CCO 10286
C=CCO 22026
C=CCNc1ccccc1 10287
COc1ccc(cc1)CC=C 10288
C=CCc1ccccc1 10289
C=CCBr 10290
C=CCCl 10291
C=CCNC1CCCCC1 10292
COc1cc(cc(c1O)OC)CC=C 10293
C=CCOCC1CO1 10294
C=CCN=C=S 10295
CSCC=C 10298
C=CCc1ccccc1O 10299
C=CCOc1ccccc1 10300
C=CCN1C(=O)CSC1=S 10301
C=CCSCC=C 10302
C=CCNC(=S)NN 10303
C=CC[P+](c1ccccc1)(c2ccccc2)c3ccccc3.[Br-] 10304
C=CCNC(=O)N 10305
c1cc(c(cc1/C(=C/2\C=CC(=O)C(=C2)C(=O)[O-])/c3ccc(c(c3)C(=O)[O-])O)C(=O)[O-])O.[NH4+].[NH4+].[NH4+] 10306
CCOC(CN)OCC 10307
CC(=O)c1ccc(cc1)N 10309
c1ccc(cc1)C(=O)CN.Cl 10310
c1ccc2c(c1)c(c3ccccc3n2)N.O.Cl 10311
c1ccc2c(c1)c(c3ccccc3n2)N.O.Cl 33040
c1ccc2cc3cc(ccc3cc2c1)N 10313
Cc1c(c(=O)n(n1C)c2ccccc2)N 10315
c1ccc(cc1)C(=O)c2ccccc2N 10316
c1ccc(cc1)C(=O)c2ccc(cc2)N 10317
c1ccc(c(c1)C(F)(F)F)N 10318
c1cc(cc(c1)N)C(F)(F)F 10319
c1cc(ccc1C(=O)NN)N 10320
c1cc(ccc1CC#N)N 10321
c1ccc(cc1)c2ccccc2N 10322
CCC(CO)N 10325
CC(CC(=O)O)N 10327
C(CC(=O)O)CN 10328
C1COC(=O)[C@H]1N.Br 25994
C(CCC(=O)O)CCN 10330
CCOC(=O)c1c[nH]nc1N 10331
c1cc(c(cc1Cl)N)C(=O)O 10332
c1cc(c(cc1Cl)C(=O)O)N 10333
c1ccc(cc1)C(=O)c2cc(ccc2N)Cl 10334
c1ccc(cc1)/C(=N\O)/c2cc(ccc2N)Cl 10335
c1cc(c(cc1C(F)(F)F)N)Cl 10336
c1cc(c(cc1N)C(F)(F)F)Cl 10337
c1cc2c(cc1Cl)nc(o2)N 10338
CSc1nc(cc(n1)Cl)N 10339
c1cc(ncc1Cl)N 10341
c1cc(c(nc1)Cl)N 10342
c1ccc2c(c1)ccc3c2cc(c4c3cccc4)N 38036
C1CCC(C1)(C(=O)O)N 10347
c1c(cc(c(c1Cl)O)Cl)N 10348
c1c(nc(nc1Cl)N)Cl 10349
c1c(nc(nc1O)N)O 10351
c1c(nc(nc1O)O)N 10352
c1c(cc(c(c1I)N)I)C(=O)O 10353
Cc1cc2c(cc1C)sc(n2)N 10355
Cc1c(nc2c(n1)c(nc(n2)N)O)C 10356
Cc1cc(nc(n1)N)C 10359
CCOc1ccc2c(c1)sc(n2)N 10362
C(COCCO)N 10363
C(COS(=O)(=O)O)N 10364
C1CN(CCN1)CCN 10368
C1CN(CCN1)CCN 40076
C1CCN(C1)CCN 10370
c1ccc-2c(c1)-c3cccc4c3c2ccc4N 10371
c1ccc-2c(c1)Cc3c2ccc(c3)N 10372
c1ccc2c(c1)-c3ccc(cc3C2=O)N 10375
C(=N)(N)NN.[N+](=O)(O)[O-] 10376
CCCCCC(C)N 10377
c1ccc2c(c1)C(=O)c3c(ccc(c3C2=O)O)N 10380
C(C(CN)O)C(=O)O 10381
c1c(nc(nc1O)S)N.O 10382
Cc1cc(nc(n1)N)O 10383
c1c2c(nc(nc2[nH]n1)O)N 10384
c1ccc2c(c1)CCC2N 10385
c1cc2c(cc[nH]2)cc1N 10390
C(CC(=O)O)C(=O)CN.Cl 10392
c1c2c(nc(nc2[nH]n1)S)N 10393
COc1ccc2c(c1)sc(n2)N 10394
COc1ccc2c(c1)sc(n2)N 17202
Cc1cccc(c1N)C(=O)O 10397
Cc1ccc(cc1N)C(=O)O 10398
Cc1cc(ccc1N)C(=O)O 10399
CSc1c2c([nH]cn2)nc(n1)N 10402
CN1CCN(CC1)N 10403
C1CNCCC1CN 10404
CC(CO)(CO)N 10405
CC(C)(CO)N 10406
c1ccnc(c1)CN 10407
c1cc(cnc1)CN 10408
Cc1ccnc(n1)N 10409
Cc1csc(n1)N 10410
C1COCCN1N 10411
c1cc2c(ccc3c2c(c1)C(=O)NC3=O)N 10413
c1ccc2cc(c(cc2c1)C(=O)O)N 10414
c1cc(c(nc1)N)C(=O)O 10416
c1cc(c(cc1C(F)(F)F)[N+](=O)[O-])N 10417
c1cc(ncc1[N+](=O)[O-])N 10423
c1c(cnc(n1)N)[N+](=O)[O-] 10424
CC1([C@@H](N2[C@H](S1)[C@@H](C2=O)N)C(=O)O)C 10425
c1ccc(c(c1)N)O 10426
c1cc(ccc1N)O 10427
c1cc(ccc1CC(=O)O)N 10428
B(c1cccc(c1)N)(O)O.B(c1cccc(c1)N)(O)O.OS(=O)(=O)O 10430
c1cc(ccc1N)Oc2ccc(cc2)N 10433
c1ccc(cc1)N2C(=O)CC(=N2)N 10434
c1ccc(cc1)N2C(=O)CC(=N2)N 40097
c1cc(cc(c1)S(=O)(=O)c2cccc(c2)N)N 10435
c1cc(ccc1N)S(=O)(=O)c2ccc(cc2)N 10436
c1ccc(cc1)c2csc(n2)N.O.Br 10437
Cc1cccnc1N 10438
Cc1ccc(nc1)N 10439
Cc1cccc(n1)N 10440
C(C(CO)O)N 10442
C(CN)CS(=O)(=O)O 10443
C[C@@H](CO)N 10445
C(CN)CO 10446
C(CN)C#N.C(CN)C#N.C(=C/C(=O)O)\C(=O)O 10447
c1[nH]c2c(n1)c(nc(n2)N)S 10448
c1cnc(cn1)N 10449
c1cnc(c(n1)C(=O)O)N 10450
c1c(c(n[nH]1)N)C(=O)O 10451
c1c2c(ncnc2[nH]n1)N 10452
c1cc2ccc3ccc(c4c3c2c(c1)cc4)N 10453
c1ccnc(c1)N 10454
c1cc(cnc1)N 10456
c1cnccc1N 10457
c1cnc(nc1)N 10458
C1C(=O)N(C(=S)S1)N 10461
c1cc(c(cc1N)O)C(=O)O 10462
c1cc(c(cc1N)C(=O)O)O 10463
c1cc(c(cc1N)C(=O)O)O 13433
c1cc(ccc1N)S 10468
c1nncn1N 10470
C(CCCCCN)CCCCC(=O)O 10471
COc1ccc(cc1OC)N 10472
c1ccc(cc1)C(C#N)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O)O)O)O 10473
CC[C@H](C)CO 10474
CC1=CCC(=O)O1 10476
c1ccc(c(c1)N)S(=O)(=O)O 10477
c1ccc(c(c1)N)S(=O)(=O)O 40064
c1ccc(cc1)NCCC#N 10478
COc1ccc(cc1)C=O 10480
COc1ccccc1N 10481
COc1cccc(c1)N 10482
COc1ccc(cc1)N 10483
COc1ccc(cc1)N 40129
COc1ccc(cc1)C(C(=O)c2ccc(cc2)OC)O 10484
COc1ccc(cc1)C(=O)Cl 10485
c1ccc2cc3ccccc3cc2c1 10486
c1ccc2cc3ccccc3cc2c1 10487
c1ccc2c(c1)cc3ccccc3c2C(=O)O 10488
c1ccc2c(c1)cc3ccccc3c2C(=O)O 35362
c1cc2c(cc1O)C(=O)c3ccc(cc3C2=O)O 10489
c1ccc(c(c1)C(=O)N)N 10490
c1ccc(c(c1)C(=O)O)N 10491
c1ccc(c(c1)C#N)N 10492
c1ccc2c(c1)C(=O)c3ccccc3C2=O 10493
c1ccc2c(c1)C(=O)c3ccccc3C2=O 21705
c1cc2c(c(c1)S(=O)(=O)[O-])C(=O)c3cccc(c3C2=O)S(=O)(=O)[O-].[Na+].[Na+] 10494
c1cc2c(cc1S(=O)(=O)[O-])C(=O)c3ccc(cc3C2=O)S(=O)(=O)[O-].[Na+].[Na+] 10495
c1ccc2c(c1)Cc3ccccc3C2=O 10496
Cc1cc(=O)n(n1C)c2ccccc2 10497
C1[C@@H]([C@@H]([C@H](C(O1)O)O)O)O 10498
C(C[C@@H](C(=O)O)N)CNC(=N)N 10499
C(C[C@@H](C(=O)O)N)CNC(=N)N.Cl 10500
C([C@@H]([C@@H]1C(=C(C(=O)O1)O)O)O)O 10502
C([C@@H]([C@@H]1C(=C(C(=O)O1)O)O)O)O 40147
C(C(C(=O)O)N)C(=O)O 10503
C([C@@H](C(=O)O)N)C(=O)O 10504
c1cc2c(nc1)nc[nH]2 10506
C1CCCNC(=O)CC1 10508
c1cc2cc[nH]c2nc1 10510
C(CCCC(=O)O)CCCC(=O)O 10512
C(CCCC(=O)O)CCCC(=O)O 40152
C1CN[C@@H]1C(=O)O 10514
CC(C)(C#N)N=NC(C)(C)C#N 10515
C(=O)(N)N=NC(=O)N 10516
COc1ccc(cc1)/N=[N+](/c2ccc(cc2)OC)\[O-] 10517
c1ccc-2cccc2cc1 10518
c1ccc(cc1)C=O 10522
c1ccc(cc1)C=O 37836
c1ccc(cc1)/C=C\2/c3ccccc3C(=O)O2 10523
c1ccc(cc1)C(=N)N.Cl 10524
c1ccc2c(c1)ccc3c2cc4ccccc4c3 10525
c1ccc2cc3cc4ccccc4cc3cc2c1 10526
c1cc(ccc1CO)CO 10528
c1ccc(cc1)S(=O)(=O)NN 10530
c1c(c(cc(c1C(=O)O)C(=O)O)C(=O)O)C(=O)O 10531
c1c2c(cc3c1c(=O)oc3=O)c(=O)oc2=O 10532
c1c(cc(cc1C(=O)O)C(=O)O)C(=O)O 10535
c1cc2c(cc1C(=O)O)C(=O)OC2=O 10537
CC(C)(C)CC(C)(C)c1ccc(cc1)OCCOCC[N+](C)(C)Cc2ccccc2.[Cl-] 10538
c1ccc(cc1)C(c2ccccc2)O 10539
c1ccc(cc1)C(=C2c3ccccc3C(=O)c4c2cccc4)c5ccccc5 38826
c1ccc(cc1)C(=O)C(=O)c2ccccc2 10541
c1ccc(cc1)C(c2ccccc2)(C(=O)O)O 10542
c1ccc(cc1)/C(=N\N)/C(=O)c2ccccc2 10543
c1ccc2c(c1)c3ccccc3nn2 10546
c1ccc2c(c1)cco2 10548
c1ccc(cc1)C(=O)OC(=O)c2ccccc2 10550
c1ccc(cc1)C(C(=O)c2ccccc2)O 10551
COC(c1ccccc1)C(=O)c2ccccc2 40192
c1ccc(cc1)C(/C(=N/O)/c2ccccc2)O 10553
c1ccc(cc1)C#N 10554
c1ccc(cc1)C#N 16767
c1cc2ccc3ccc4ccc5cccc6c5c4c3c2c6c1 10555
c1ccc(cc1)C(=O)c2ccccc2 10556
c1ccc(cc1)C(=O)c2ccccc2 21968
c1ccc(cc1)C(=NN)c2ccccc2 10557
c1cc2c(cc1C(=O)c3ccc4c(c3)C(=O)OC4=O)C(=O)OC2=O 10558
c1cc2c(cc1C(=O)c3ccc4c(c3)C(=O)OC4=O)C(=O)OC2=O 40193
c1ccc(cc1)C(c2ccccc2)(C(c3ccccc3)(c4ccccc4)O)O 10559
c1ccc2c(c1)ccc3c2cccn3 10562
C1=CC(=O)C=CC1=O 10563
C1=CC(=NO)C=CC1=NO 10564
c1ccc2c(c1)[nH]nn2 10567
c1ccc2c(c1)[nH]nn2 18388
c1ccc2c(c1)nco2 10568
CC(=O)CC(=O)c1ccccc1 10569
CCOC(=O)[C@H](CCCNC(=N)N)NC(=O)c1ccccc1.Cl 10570
c1ccc(cc1)C(=O)c2ccccc2C(=O)O 10571
c1ccc(cc1)C(=O)c2ccc(cc2)C(=O)O 10572
c1ccc(cc1)c2ccc(cc2)C(=O)c3ccccc3 10573
c1ccc(cc1)C(=O)Cl 10575
c1ccc(cc1)C(=O)Cl 40203
c1ccc(cc1)C(=O)C(=O)O 10576
c1ccc(cc1)C(=O)NN 10577
c1ccc(cc1)C(=O)CCC(=O)O 10579
c1ccc(cc1)C(=O)c2ccccn2 10580
c1ccc(cc1)C(=O)c2cccnc2 10581
CC(=O)OCc1ccccc1 10582
CC(=O)CCc1ccccc1 10583
CC(=O)CCc1ccccc1 34519
c1ccc(cc1)CO 10584
c1ccc(cc1)CO 14839
c1ccc(cc1)CO 39122
c1ccc(cc1)CN 10585
c1ccc(cc1)CN 18093
c1ccc(cc1)COC(=O)c2ccccc2 10586
c1ccc(cc1)CBr 10587
c1ccc(cc1)COC(=O)N 10589
CCOC(=O)C1CN(CCC1=O)Cc2ccccc2.Cl 10590
c1ccc(cc1)CSC[C@@H](C(=O)O)N 10592
c1ccc(cc1)CNCCO 10594
CCOC(=O)CNCc1ccccc1 10595
c1ccc(cc1)CNN.Cl.Cl 10596
c1ccc(cc1)CON.Cl 10597
c1ccc(cc1)CC2(CCNCC2)O 10599
C/N=C/c1ccccc1 10601
CNCc1ccccc1 10604
c1ccc(cc1)COc2cccc(c2)C=O 10607
c1ccc(cc1)COc2ccc3c(c2)cc[nH]3 10609
c1ccc(cc1)COc2ccc3c(c2)c(c[nH]3)CCN.Cl 10611
c1ccc(cc1)CSc2ccccc2 10612
c1ccc(cc1)CN2CCC(=O)CC2 10613
c1ccc(cc1)Cc2ccccn2 10615
c1ccc(cc1)Cc2ccncc2 10616
c1ccc(cc1)CSC#N 10618
c1ccc(cc1)CSCC(=O)O 10619
C[N+](C)(C)Cc1ccccc1.[OH-] 10620
c1ccc(cc1)C[P+](c2ccccc2)(c3ccccc3)c4ccccc4.[Cl-] 10621
c1ccc2c(c1)/C(=C\3/c4ccccc4C(=O)c5c3cccc5)/c6ccccc6C2=O 10622
c1ccc(cc1)CCc2ccccc2 10623
c1ccc(cc1)c2ccccc2 10625
c1ccc(cc1)c2ccc(cc2)C=O 10626
c1ccc(cc1)c2ccccc2C(=O)O 10627
c1ccc(cc1)c2ccc(cc2)C(=O)O 10628
c1ccc2c(c1)ccc(n2)c3ccc4ccccc4n3 10630
C(CCl)NCCCl.Cl 10632
Cc1c(cc(c(c1CN(CC(=O)[O-])CC(=O)[O-])O)C(C)C)C2(c3ccccc3S(=O)(=O)O2)c4cc(c(c(c4C)CN(CC(=O)[O-])CC(=O)[O-])O)C(C)C.[Na+].[Na+].[Na+].[Na+] 10637
Cc1c(nc([nH]1)c2[nH]c(c(n2)C)C)C 10639
C1CN(CCN1CCO)CCO 10640
C1CCN(CC1)C(=O)N2CCCCC2 10645
c1ccc(cc1)c2cnc(o2)c3ccc(cc3)c4ncc(o4)c5ccccc5 10646
c1ccc(cc1)c2cnc(o2)c3ccc(cc3)c4ncc(o4)c5ccccc5 41816
c1cnccc1CCc2ccncc2 10647
c1cnccc1c2nnc(s2)c3ccncc3 10650
CCCC[Sn](CCCC)(CCCC)O[Sn](CCCC)(CCCC)CCCC 10651
C(=O)(N)NC(=O)N 10652
C(=O)(N)NC(=O)N 61212
CC(=O)OC1CC2CCC1(C2(C)C)C 10655
c1cc2c3c(ccc(c3c1)Br)CC2 10656
C(C(=O)O)Br 10657
C(C(=O)O)Br 13447
CC(=O)c1cccc(c1)Br 10658
CC(=O)c1ccc(cc1)Br 10659
C(C(=O)Br)Br 10660
c1ccc(c(c1)N)Br 10661
COc1cccc(c1)Br 10662
COc1ccc(cc1)Br 10663
c1ccc2c(c1)cc3ccccc3c2Br 10664
c1ccc(c(c1)C=O)Br 10665
c1cc(cc(c1)Br)C=O 10666
c1cc(ccc1C=O)Br 10667
c1ccc(cc1)Br 10668
c1ccc(c(c1)C#N)Br 10669
c1cc(cc(c1)Br)C#N 10670
c1cc(ccc1C#N)Br 10671
c1ccc(cc1)C(=O)c2ccc(cc2)Br 10672
c1ccc(c(c1)C(F)(F)F)Br 10673
c1cc(cc(c1)Br)C(F)(F)F 10674
c1ccc(c(c1)C(=O)Cl)Br 10675
c1cc(ccc1C(=O)Cl)Br 10676
CCCCBr 10677
CCCCBr 21971
CCC(C)Br 10678
C1COC(=O)C1Br 10679
C(CC#N)CBr 10680
C(CC#N)CBr 40292
CC12CCC(C1(C)CS(=O)(=O)[O-])C(C2=O)Br.[NH4+] 10681
c1ccc(c(c1)Cl)Br 10682
c1cc(ccc1Cl)Br 10683
c1cc(ccc1Cl)Br 21972
C(CCBr)CCl 10684
C(CCl)CBr 10686
C(CCl)CBr 21706
Cc1cc(cc(c1Br)C)O 10687
c1ccc(cc1)C(CCBr)(C#N)c2ccccc2 10688
c1ccc(cc1)C(c2ccccc2)Br 37346
CCCCCCCCCCCCBr 10691
C(CBr)O 10692
C(CBr)N.Br 10693
c1ccc(cc1)CCBr 10694
CCc1ccccc1Br 10695
CCOCCBr 36740
c1ccc2c(c1)C(=O)N(C2=O)CCBr 10697
c1ccc2c(c1)-c3ccccc3C2Br 10698
c1ccc(c(c1)F)Br 10699
c1cc(cc(c1)Br)F 10700
c1cc(ccc1F)Br 10701
c1cc(oc1C(=O)O)Br 10702
CCCCCCCBr 10703
CCCCCCBr 10704
c1ccc2c(c1)CC(C2O)Br 10705
c1cc2c(cc[nH]2)cc1Br 10706
c1cc2c(cc1Br)c(c[nH]2)CC(=O)O 10707
c1ccc2c(c1)cncc2Br 10709
CCCCCCCCCCC(C(=O)O)Br 10710
c1cc(ccc1C(C(=O)O)O)Br 10711
Cc1cc(c(c(c1)C)Br)C 10712
Cc1ccc(c(c1)Br)O 10714
c1ccc2c(c1)cccc2Br 10715
c1ccc2c(c1)ccc(c2Br)O 10716
c1cc(cc2c1cc(cc2)Br)O 10717
c1c(sc(n1)Br)[N+](=O)[O-] 10718
Cc1ccc(cc1Br)[N+](=O)[O-] 10719
CCCCCCCCCBr 10720
C1CC2CC1CC2Br 10721
c1(c(c(c(c(c1F)F)Br)F)F)F 10722
CCCC(C)Br 10723
c1ccc2c(c1)cc(c3c2cccc3)Br 10724
c1ccc(cc1)OCCBr 10725
B(c1ccc(cc1)Br)(O)O 10728
c1ccc(cc1)CCCBr 10729
CC(Cc1ccccc1)Br 37976
CCCBr 10731
CC(C)Br 10732
CC(=C)Br 10734
CC(C(=O)O)Br 10735
CCC(=O)c1ccc(cc1)Br 10737
C(CN)CBr.Br 10738
c1ccc2c(c1)C(=O)N(C2=O)CCCBr 10739
c1ccnc(c1)Br 10740
c1cc(cnc1)Br 10741
c1cnccc1Br.Cl 10742
c1cc(c(cc1O)O)Br 10743
C(C(C(=O)O)Br)C(=O)O 10744
C1CC(=O)N(C1=O)Br 10745
c1cc(ccc1S)Br 10746
Cc1ccccc1Br 10747
Cc1ccc(cc1)Br 10748
C(Cl)(Cl)(Cl)Br 10749
c1cc2c(cc1Br)c(c[nH]2)CC(C(=O)O)N 10751
C(CCCCCBr)CCCCC(=O)O 17322
C(CCCCCBr)CCCCC(=O)O 42316
C(CCBr)CC#N 10753
COc1ccc(cc1OC)Br 10754
Cc1ccccc1CBr 10755
Cc1ccc(cc1)CBr 10757
Cc1cccc(c1C)Br 10758
Cc1ccc(cc1C)Br 10759
Cc1ccc(c(c1)C)Br 10760
Cc1ccc(c(c1)C)Br 29452
Cc1ccc(c(c1)C)Br 33204
C1C=CCS1(=O)=O 10761
CC(CCO)O 10762
C(CCO)CO 10763
CC(=O)C(=O)C 10765
C(CCS)CS 10766
C1CCS(=O)(=O)OC1 10767
C(CO)C(CO)O 10768
CCCCO 10769
CCCCO 16769
CCCCO 23208
CCCCO 42349
CCCCO 61002
CCCCO 61025
CCC(C)O 10770
CCC(C)O 22029
CCC(C)O 61026
CC(C)(C)O 10771
CC(C)(C)O 39069
C(/C=C/CO)O 10772
CC(C=C)O 38707
CCCCOc1ccc(cc1)O 10774
CCCCOC(=O)C 10775
CCCCOC(=O)C 16768
CCCCOC(=O)C 32785
CC(=O)OC(C)(C)C 10776
CC(C)(C)CC(=O)O 10777
CC(=O)CC(=O)OC(C)(C)C 10778
CC(C)(C)CC(=O)Cl 10779
CCCCN 10780
CCCCN 21974
CCC(C)N 10781
CC(C)(C)N 10782
CC(C)(C)NCCO 10784
CCCCc1ccccc1 10785
CCC(C)c1ccccc1 10786
CC(C)(C)c1ccccc1 10787
CC(C)(C)OC(=O)NN 10788
CC(C)(C)C1CCCCC1 10789
CC(C)(C)C1CCC(CC1)O 10790
CC(C)(C)C1CCC(=O)CC1 10791
CCCCSSCCCC 10792
Cc1ccc(c(c1)C(C)(C)C)O 10796
CCC(C)c1ccccc1O 10798
CC(C)(C)c1ccccc1O 10799
CC(C)(C)c1ccc(cc1)O 10800
CCCCSCCCC 10801
CCCCS(=O)CCCC 10804
CCCC[P+](c1ccccc1)(c2ccccc2)c3ccccc3.[Br-] 10806
CCCCNC(=O)N 10807
C(C#CCO)O 10808
C(C#CCO)O 40371
CCCC=O 10809
CCCC=O 22030
CCCC(=O)N 10810
CCCC(=O)O 10811
CCCC(=O)OC(=O)CCC 10812
CCCC(=O)OC(=O)CCC 18095
C1CC(=O)OC1 10813
CCCC#N 10814
CCCC#N 21976
CCCC(=O)SCC[N+](C)(C)C.[I-] 10815
Cn1cnc2c1c(=O)n(c(=O)n2C)C 10816
Cc1ccc(c(c1)N=Nc2c3ccccc3c(cc2O)S(=O)(=O)O)O 10817
CC1(C2CCC1(C(=O)C2)C)C 10819
CC1([C@H](CC[C@@]1(C)C(=O)O)C(=O)O)C 10820
CC1(C2CCC1(C(=O)OC2=O)C)C 10821
CC1(C2CCC1(C(=O)C2)CS(=O)(=O)O)C 10822
C1CCC(=O)NCC1 10823
C1CCC(=O)NCC1 22031
C[N+](C)(C)CCOC(=O)N.[Cl-] 10824
c1ccc2c(c1)c3ccccc3[nH]2 10826
CCOC(=O)C=P(c1ccccc1)(c2ccccc2)c3ccccc3 10829
CCOC(=O)C[P+](c1ccccc1)(c2ccccc2)c3ccccc3.[Br-] 10830
CCOC(=O)N1C(=O)c2ccccc2C1=O 10831
c1ccc(cc1)COC(=O)N[C@H](CC(=O)N)C(=O)O 10834
c1ccc(cc1)COC(=O)NCC(=O)O 10835
c1ccc(cc1)COC(=O)NCCCC[C@@H](C(=O)O)N 10836
c1ccc(cc1)COC(=O)N2CCC[C@H]2C(=O)O 10837
c1ccc(cc1)COC(=O)NC(CO)C(=O)O 10838
c1cc(ccc1C(=O)O)S(=O)(=O)N 39317
C(C(=O)O)ON.C(C(=O)O)ON.Cl 10843
C(CC(=O)O)CSSCCCC(=O)O 10844
C[N+](C)(C)CC(CC(=O)O)O.[Cl-] 10845
C(C1[C@H](C([C@@H]([C@@H](O1)O[C@@H]2[C@@H](O[C@H](C(C2O)O)O)CO)O)O)O)O 10846
C1(=C(C(=O)C(=C(C1=O)Cl)O)Cl)O 10848
CCOC(CCl)OCC 10849
COC(CCl)OC 10850
C(C(=O)O)Cl 10851
C(C(=O)O)Cl 22032
C(C#N)Cl 10852
c1ccc(cc1)C(=O)CCl 10853
c1ccc(cc1)C(=O)CCl 33804
CC(=O)c1ccc(cc1)Cl 10854
C(=C/Cl)\C(=O)O 10855
C=C(C#N)Cl 10856
c1ccc(c(c1)N)Cl 10857
c1cc(cc(c1)Cl)N 10858
c1cc(ccc1N)Cl 10859
c1ccc2c(c1)C(=O)c3cccc(c3C2=O)Cl 10860
c1cc(cc(c1)Cl)C=O 10861
c1cc(ccc1C(=O)N)Cl 10862
c1cc(ccc1S(=O)(=O)N)Cl 10863
c1ccc(cc1)C(c2ccc(cc2)Cl)N3CCNCC3 10865
c1cc(cc(c1)Cl)C(=O)O 10866
c1ccc(c(c1)C#N)Cl 10867
c1cc(cc(c1)Cl)C#N 10868
c1ccc(cc1)C(=O)c2ccc(cc2)Cl 10869
c1cc2c(cc1Cl)nn[nH]2 10870
c1cc(ccc1C(Cl)(Cl)Cl)Cl 10871
c1ccc(c(c1)C(F)(F)F)Cl 10872
c1cc(ccc1C(F)(F)F)Cl 10873
c1cc(cc(c1)Cl)C(=O)Cl 10874
c1cc(ccc1C(=O)c2ccncc2)Cl 10875
c1cc(cc(c1)Cl)CO 10876
c1cc(ccc1CO)Cl 10877
c1ccc(c(c1)CN)Cl 10878
c1cc(ccc1CN)Cl 10879
c1cc(cc(c1)Cl)CC#N 10880
c1cc(ccc1CC#N)Cl 10881
c1cc(ccc1CS)Cl 10882
CCC(C)Cl 10883
CCCC(=O)c1ccc(cc1)Cl 10889
C(CC(=O)Cl)CCl 10890
c1ccc(c(c1)/C=C/C(=O)O)Cl 10892
c1cc(cc(c1)Cl)/C=C/C(=O)O 10893
c1cc(ccc1/C=C/C(=O)O)Cl 10894
C1CCC(C(C1)O)Cl 10895
C1CCC(=O)C(C1)Cl 10896
C1CC(C(=O)C1)Cl 10897
CCCCCCCCCCCl 10898
c1c(nc(nc1Cl)N)N 10899
c1(nc(nc(n1)Cl)N)N 10900
C(=O)(C(F)(F)Cl)O 10902
COc1cc(c(cc1N)Cl)OC 10905
Cc1cc(cc(c1Cl)C)O 10906
c1ccc(cc1)C(c2ccccc2)(C(=O)Cl)Cl 10912
c1ccc(cc1)P(c2ccccc2)Cl 10913
c1ccc(cc1)P(c2ccccc2)Cl 34730
C(CCl)O 10914
C(CCl)O 18096
c1ccc(cc1)CCCl 10916
CCOCCCl 10918
C1COCCN1CCCl.Cl 10920
C1CCN(CC1)CCCl.Cl 10921
c1cc(ccc1C(=O)CCCCl)F 10923
c1cc(c(cc1/C=C/C(=O)O[C@@H]2C[C@@](C[C@H]([C@H]2O)O)(C(=O)O)O)O)O 10924
c1cc(c(cc1Cl)N)O 10925
c1cc(c(cc1C(=O)O)Cl)O.c1cc(c(cc1C(=O)O)Cl)O.O 10926
c1cc(ccc1C(=O)CCCCl)O 10927
C(CCCCl)CCO 10928
C(CO)CCl 10929
c1cc2c(ccc(c2nc1)O)Cl 10930
c1cc2c(cc[nH]2)cc1Cl 10931
c1cc2c(cc1Cl)cc([nH]2)C(=O)O 10932
Cc1ccc(cc1N)Cl 10938
c1ccc2c(c1)[nH]c(n2)CCl 10939
Cc1cc2cc(ccc2[nH]1)Cl 10941
c1ccc2c(c1)cccc2CCl 10945
Cc1cc(ccc1Cl)O 10948
CN1CCC(CC1)Cl.Cl 10949
CC(C)(C)Cl 10950
c1ccc2c(c1)ccc(n2)CCl.Cl 10951
CC(=C)c1ccc(cc1)Cl 10952
c1ccc(cc1)[P+](CCl)(c2ccccc2)c3ccccc3.[Cl-] 10953
C(=O)N 42374
C(=O)N 18109
C(=O)N 41075
C(=O)N 32723
C(=O)N 41076
C(=O)N 20582
c1cc(c(cc1[N+](=O)[O-])N)Cl 10957
c1cc(c(cc1N)[N+](=O)[O-])Cl 10958
c1cc(c(cc1C=O)[N+](=O)[O-])Cl 10960
c1ccc(c(c1)[N+](=O)[O-])Cl 10962
c1cc(ccc1[N+](=O)[O-])Cl 10963
c1cc(c(cc1[N+](=O)[O-])Cl)C(=O)O 10965
c1cc(c(cc1Cl)[N+](=O)[O-])C(=O)O 10966
c1cc(c(cc1C(=O)O)[N+](=O)[O-])Cl 10967
c1cc(c(cc1Cl)C(=O)O)[N+](=O)[O-] 10968
c1cc(c(cc1[N+](=O)[O-])C(F)(F)F)Cl 10969
c1cc(c(cc1C(F)(F)F)[N+](=O)[O-])Cl 10970
c1cc(c(cc1Cl)C(F)(F)F)[N+](=O)[O-] 10971
c1cc(c(cc1[N+](=O)[O-])Cl)O 10972
c1cc(c(nc1)Cl)[N+](=O)[O-] 10973
c1cc(ncc1[N+](=O)[O-])Cl 10974
CC(=O)CCCCl 38829
c1cc(cc(c1)Cl)O 10981
c1cc(ccc1O)Cl 10982
c1cc(ccc1O)Cl 18100
c1cc(ccc1O)Cl 40493
c1ccc2c(c1)Nc3cc(ccc3S2)Cl 10983
c1ccc2c(c1)Nc3cc(ccc3S2)Cl 33455
c1cc(cc(c1)Cl)CC(=O)O 10984
c1cc(ccc1C(=O)C2CC2)Cl 10986
c1cc(ccc1CCN)Cl 10988
c1cc(ccc1C2=CCNCC2)Cl.Cl 10993
CCCCl 10995
CC(C)Cl 10996
CC(C)Cl 22033
C(CCl)C(=O)Cl 10999
CCC(=O)c1ccc(cc1)Cl 11000
c1ccnc(c1)Cl 11001
c1cc(cnc1)Cl 11002
c1cnccc1Cl.Cl 11003
c1ccc2c(c1)ccc(n2)Cl 11004
c1cc(c(cc1O)O)Cl 11006
c1cc(c(cc1Cl)C(=O)O)O 11007
C=Cc1cccc(c1)Cl 11008
C=Cc1ccc(cc1)Cl 11009
Cn1c2c(c(=O)n(c1=O)C)[nH]c(n2)Cl 11010
C[Si](C)(C)Cl 11012
C[Si](C)(C)Cl 38160
C[Si](C)(C)Cl 38161
C(CCCl)CC#N 11014
Cc1ccccc1CCl 11015
Cc1cccc(c1)CCl 11016
Cc1ccc(cc1)CCl 11017
CC(C)CCC[C@@H](C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC=C4[C@@]3(CC[C@@H](C4)O)C)C 11019
CC(C)CCC[C@@H](C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC=C4[C@@]3(CC[C@@H](C4)OC(=O)c5ccccc5)C)C 11020
CC(C)CCC[C@@H](C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC=C4[C@@]3(CC[C@@H](C4)OC(=O)Cl)C)C 11023
CCCCCCC(=O)O[C@H]1CC[C@@]2([C@H]3CC[C@]4([C@H]([C@@H]3CC=C2C1)CC[C@@H]4[C@H](C)CCCC(C)C)C)C 11024
CCCCCCCCCCCCCCCC(=O)O[C@H]1CC[C@@]2([C@H]3CC[C@]4([C@H]([C@@H]3CC=C2C1)CC[C@@H]4[C@H](C)CCCC(C)C)C)C 11026
CCCCCCCCC(=O)O[C@H]1CC[C@@]2([C@H]3CC[C@]4([C@H]([C@@H]3CC=C2C1)CC[C@@H]4[C@H](C)CCCC(C)C)C)C 11027
CCCCCCCCCCCCCCCCCC(=O)O[C@H]1CC[C@@]2([C@H]3CC[C@]4([C@H]([C@@H]3CC=C2C1)CC[C@@H]4[C@H](C)CCCC(C)C)C)C 11028
C[N+](C)(C)CCO.[Cl-] 11029
C[N+](C)(C)CCO.[Cl-] 21977
c1ccc2c(c1)ccc3c2ccc4c3cccc4 11031
c1ccc(cc1)c2cc(=O)c3c(cc(cc3o2)O)O 11032
C=C[C@H]1CN2CCC1C[C@H]2[C@@H](c3ccnc4c3cccc4)O 11033
CC1(C2CCC(O1)(CC2)C)C 11034
c1ccc(cc1)/C=C/C=O 11035
c1ccc(cc1)/C=C/C=O 21978
c1ccc(cc1)/C=C/C(=O)N 11036
c1ccc(cc1)/C=C/C#N 11038
c1ccc(cc1)/C=C/C(=O)Cl 11039
c1ccc(cc1)/C=C/CBr 11040
C/C(=C/C(=O)O)/C(=O)O 11043
CC(=CCC/C(=C/C=O)/C)C 11044
C(C(=O)O)C(CC(=O)O)(C(=O)O)O 11045
C(C(=O)O)C(CC(=O)O)(C(=O)O)O 22034
C(C(=O)O)C(CC(=O)O)(C(=O)O)O 32986
C(C(=O)O)C(CC(=O)O)(C(=O)O)O 42356
C(C(=O)O)C(CC(=O)O)(C(=O)O)O 61138
CC(CCC=C(C)C)CCO 11046
C(C[C@@H](C(=O)O)N)CNC(=O)N 11047
Cc1cc(nc(c1)C)C 11049
Cc1cc(nc(c1)C)C 16195
Cc1cc(nc(c1)C)C 42205
c1ccc2c(c1)c(cc(c2N)N=Nc3ccc(cc3)c4ccc(cc4)N=Nc5cc(c6ccccc6c5N)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+] 11050
c1ccc2c(c1)c(cc(c2N)N=Nc3ccc(cc3)c4ccc(cc4)N=Nc5cc(c6ccccc6c5N)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+] 22962
c1ccc2c(c1)c(cc(c2N)N=Nc3ccc(cc3)c4ccc(cc4)N=Nc5cc(c6ccccc6c5N)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+] 40536
c1ccc2c(c1)c(cc(c2N)N=Nc3ccc(cc3)c4ccc(cc4)N=Nc5cc(c6ccccc6c5N)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+] 61312
c1cc2ccc3ccc4ccc5ccc6ccc1c7c2c3c4c5c67 11051
c1cc(=O)occ1C(=O)O 11052
c1ccc2c(c1)ccc(=O)o2 11053
Cc1ccccc1O 11055
Cc1ccccc1O 11056
Cc1cccc(c1)O 11058
Cc1ccc(cc1)O 11059
Cc1ccc(cc1)O 40574
Cc1cc(ccc1O)C2(c3ccccc3C(=O)O2)c4ccc(c(c4)C)O 38024
CC(C)c1ccccc1 11063
CC(C)c1ccccc1 18101
CC(C)c1ccccc1 32973
CC(C)(c1ccccc1)c2ccc(cc2)O 11064
CC1=O[Cu+2]2(O=C([CH-]1)C)O=C([CH-]C(=O2)C)C 11065
C(C#N)C(=O)O 11067
C(C#N)C(=O)NN 11068
c1cc(ccc1C=O)C#N 11072
c1cc(ccc1C#N)C(=O)O 11073
Cc1cc(nc(c1C#N)O)C 11074
C(COCCC#N)C#N 11076
C(COCCC#N)C#N 34395
c1ccn(c1)CCC#N 11077
C(#N)Br 11078
C(#N)Br 35399
c1cc2c(cc[nH]2)cc1C#N 11079
c1ccc2c(c1)cccc2C#N 11080
c1ccc2c(c1)cc(c3c2cccc3)C#N 11081
c1cc(cc(c1)O)C#N 11082
c1cc(ccc1C#N)O 11083
c1ccc(cc1)C2(CCNCC2)C#N.Cl 11084
c1ccnc(c1)C#N 11085
c1cc(cnc1)C#N 11086
c1cnccc1C#N 11087
c1(nc(nc(n1)Cl)Cl)Cl 11089
C1CC(C1)C(=O)O 11090
C1CC(C1)C(=O)Cl 11091
C1CC(C1)(C(=O)O)C(=O)O 11092
C1CC(=O)C1 11093
C1CCCCCC2C(O2)CCCC1 36719
C1CCCCCC(CCCCC1)O 11096
C1CCCCCC(=O)CCCCC1 11097
C/1C/C=C/CC/C=C/CC/C=C1 11098
C1CCCCC/C=C\CCCC1 38511
C1CCCCCC(CCCCC1)N 11100
C1CCCCCC1 11101
C1CCCC(CC1)O 11103
C1CCCC(=O)CC1 11104
C1CCCC(CC1)N 11107
C1CCCC(CC1)Br 11108
C1CC=CC=C1 11110
C1CCCCC1 11111
C1CCCCC1 16774
C1CCCCC1 17681
C1CCCCC1 27959
C1CCCCC1 32659
C1CCCCC1 32683
C1CCCCC1 36466
C1CCCCC1 40602
C1CCCCC1 61004
C1CCCCC1 61015
C1CCCCC1 61029
C1CCCCC1 21057
C1CCC(C(C1)O)O 11113
C1CC(CC(C1)O)O 11114
C1CCC(=O)C(=O)C1 11116
C1CC(=O)CC(=O)C1 11117
C1CC/C(=N\O)/C(=N/O)/C1 11118
C1CCC(=O)CC1 11119
C1CCC(=NO)CC1 11120
C1CCC2C(C1)O2 11121
C1CCC2C(C1)S2 11122
C1CC=CC(=O)C1 11124
C1CCC(=CC1)CC#N 11125
C1CCC(CC1)N 11128
C1CCC(CC1)N 22035
c1ccc(cc1)C2CCCCC2 11129
C1CCC(CC1)Cl 11130
C1CCC(CC1)N=C=O 11131
C1CCC(CC1)N=C=S 11132
C1CCC(CC1)S 11133
Cc1ccc(cc1)S(=O)(=O)[O-].C[N+]1(CCOCC1)CCN=C=NC2CCCCC2 11136
C1CCC(CC1)NC(=S)NCCN2CCOCC2 11137
c1ccc(cc1)C(C#N)C2CCCCC2 11139
C1CCCC(=O)CCC1 11144
C1CCCC2C(O2)CC1 11145
C1CCCC(CCC1)N 11146
C1CCCCCCCC(=O)CCCCCC1 11147
C1CCCC1 11148
C1CCCC1 16775
C1CCC(C1)C(=O)O 11149
C1[C@H]([C@H]([C@H]([C@H]1C(=O)O)C(=O)O)C(=O)O)C(=O)O 11150
C1CCC(C1)O 11152
C1CCC(=O)C1 11153
C1CC(=O)C=C1 11157
C1CC=C(C1)N2CCOCC2 11158
C1CCC(C1)N 11159
C1CCC(C1)Br 11160
C1CCC(C1)CCC(=O)O 11161
C1CC1C(=O)O 11162
C1CC1C(=O)Cl 11163
C1CC1Br 11164
C1CC1CO 11165
C1CC1CO 29682
C1CC1C#N 11166
c1ccc(cc1)C(c2ccccc2)(C3CC3)O 11167
c1cc(ccc1C(=O)C2CC2)F 11168
CC(C1CC1)O 11170
CC(=O)C1CC1 11171
c1ccc(cc1)C(C2CC2)O 11172
c1cc(sc1)C(=O)C2CC2 11174
Cc1ccc(cc1)C(C)C 11176
C(CSSCCN)N.Cl.Cl 11177
CCOC(=O)[C@H](CS)N.Cl 11179
C([C@@H](C(=O)O)N)SSC[C@@H](C(=O)O)N 11180
c1cn(c(=O)nc1N)[C@H]2[C@@H]([C@@H]([C@H](O2)CO)O)O 11181
c1(c(c(c(c(c1F)F)F)F)F)c2c(c(c(c(c2F)F)F)F)F 11183
C1CCC2CCCCC2C1 11184
C1CCC2CC(CCC2C1)O 11185
CCCCCCC1CCC(=O)O1 11186
CCCCCCCCCC 11187
C(CCCCCC(=O)O)CCCCC(=O)O 11188
C(CCCCCO)CCCCO 18104
CCCCCCCCCC(=O)O 11190
CCCCCCCCCC(=O)O 16727
CCCCCCCCC=C 11191
CC1=CC(=O)C(C(=O)O1)C(=O)C 11194
CC(C)CCC[C@@H](C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3C2=CC=C4[C@@]3(CC[C@@H](C4)O)C)C 11195
c1ccc(cc1)CC(=O)c2ccccc2 11196
C1[C@H]([C@H]([C@H](OC1O)CO)O)O 11197
C1[C@H]([C@@H]([C@H](OC1O)CO)O)O 11198
COc1ccc(cc1)CC(=O)c2ccc(cc2)OC 11199
CC(=O)NC(=O)C 11200
CC1(OCC(O1)[C@@H]2[C@@H]([C@@H]3[C@H](O2)OC(O3)(C)C)O)C 11201
C=CCNCC=C 11204
c1cc(c(cc1c2ccc(c(c2)N)N)N)N 11208
c1cc(c(cc1c2ccc(c(c2)N)N)N)N 32800
c1cc(c(cc1C(=O)O)N)N 11210
c1c(cc(cc1N)N)C(=O)O 11211
C(CCN)CN 11212
C(CCCCCN)CCCCN 11213
C(CCCN)CCCN 11220
C(C(CN)O)N 11222
c1(c(n[nH]c1O)N)N.OS(=O)(=O)O 11223
c1c(nc(nc1O)N)N 11224
c1c(nc(nc1S)N)N.c1c(nc(nc1S)N)N.OS(=O)(=O)O 11227
c1cc2c(cccc2N)c(c1)N 11229
c1cc2cccc(c2c(c1)N)N 29509
c1cc2cccc(c2c(c1)N)N 37118
C(CCCCN)CCCN 11231
C(CCN)CCN 11232
c1ccc(cc1)c2c(nc(s2)N)N.Br 11234
C(CN)CN 11235
C(CN)CN 21980
C(C(C(=O)O)N)N.Br 11237
c1cc(nc(c1)N)N 11238
c1cncc(c1N)N 11239
c1c(ncnc1N)N.c1c(ncnc1N)N.O.O.OS(=O)(=O)O 11241
Cc1ccc(c(c1)N)N 11243
c1([nH]nc(n1)N)N 11244
C1CN2CCN1CC2 11247
c1ccc2cc3c4ccccc4c5ccccc5c3cc2c1 11250
c1ccc2c(c1)ccc3ccccc3c2=O 11253
c1ccc2c(c1)c3ccccc3s2 11254
c1ccc2c(c1)-c3ccccc3S2(=O)=O 11255
c1ccc(cc1)C(=O)c2ccccc2C(=O)c3ccccc3 11256
c1ccc(cc1)C(=O)/C=C/C(=O)c2ccccc2 11258
c1ccc(cc1)C(=O)CC(=O)c2ccccc2 11260
c1ccc(cc1)CNCc2ccccc2 11261
c1ccc(cc1)COP(=O)(O)OCc2ccccc2 11265
c1ccc(cc1)COP(=O)OCc2ccccc2 11266
c1cc(ccc1C(=O)CBr)Br 11268
c1cc(c(cc1Br)Br)N 11269
c1ccc2c(c1)c(c3ccccc3c2Br)Br 11271
c1cc(ccc1Br)Br 11273
C1CC[C@H]([C@@H](C1)Br)Br 11277
C(CCCCCBr)CCCCBr 11278
C(CBr)Br 11279
C(CCCBr)CCBr 11281
c1cc2c(cc(c(c2nc1)O)Br)Br 11282
C(Br)Br 11283
C(Br)Br 21981
Cc1cc(c(c(c1)Br)O)Br 11284
c1cc(c(cc1Br)[N+](=O)[O-])Br 11286
C(CCCCBr)CCCCBr 11287
C(CCCCBr)CCCBr 11288
c1cc(ncc1Br)Br 11290
c1cc(nc(c1)Br)Br 11291
c1c(cc(c(c1C(=O)O)O)Br)Br 11292
c1ccc(c(c1)CBr)CBr 11293
c1cc(ccc1CBr)CBr 11294
CCCCNCCCC 11295
CCCCNCCCC 21982
CCCCNCCCC 39061
CCCCN(CCCC)CCCN 11296
CC(C)(C)c1cc(c(c(c1)O)O)C(C)(C)C 11297
CCCCN(CCCC)C=O 11298
Cc1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C 11299
Cc1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C 21983
CC(C)(C)c1cccc(c1O)C(C)(C)C 11300
CC(C)(C)c1cccc(c1O)C(C)(C)C 40663
CCCCNC(=S)NCCCC 11302
CCCCNC(=S)NCCCC 40667
C(C(=O)N)(Cl)Cl 11305
C(C(=O)O)(Cl)Cl 11306
c1ccc(cc1)C(=O)C(Cl)Cl 11307
C(C(=O)Cl)(Cl)Cl 11308
c1cc(c(c(c1)Cl)Cl)N 11309
c1cc(c(c(c1)Cl)N)Cl 11310
c1cc(c(cc1N)Cl)Cl 11311
c1c(cc(cc1Cl)Cl)N 11312
c1c(cc(c(c1C(=O)O)N)Cl)Cl 11313
c1cc2c(c(c1)Cl)C(=O)c3cccc(c3C2=O)Cl 11314
c1cc(c(c(c1)Cl)C=O)Cl 11316
c1ccc(c(c1)Cl)Cl 11318
c1ccc(c(c1)Cl)Cl 22205
c1cc(ccc1Cl)Cl 11319
c1cc(c(c(c1)Cl)C(=O)O)Cl 11320
c1c(cc(cc1Cl)Cl)C(=O)O 11321
c1cc(c(c(c1)Cl)C#N)Cl 11322
c1cc(c(cc1Cl)Cl)CN 11323
c1cc(c(cc1CN)Cl)Cl 11324
C(CCCl)CCl 21643
CC(C(C)Cl)Cl 11327
C(C#CCCl)Cl 11328
C1CC[C@H]([C@@H](C1)Cl)Cl 11329
C(#N)C1=C(C(=O)C(=C(C1=O)Cl)Cl)C#N 11330
C[Si](C)(Cl)Cl 11331
c1c(c(c(c(c1[N+](=O)[O-])Cl)[N+](=O)[O-])Cl)C(=O)O 11332
c1ccc(cc1)C(c2ccccc2)(Cl)Cl 11333
c1ccc(cc1)[Si](c2ccccc2)(Cl)Cl 11334
C(CCl)Cl 11336
C(CCl)Cl 16776
C(CCl)Cl 32684
C(CCl)Cl 32786
C(CCl)Cl 40681
C(CCl)Cl 40682
C(CCl)Cl 40683
C(CCl)Cl 40680
C(=C\Cl)\Cl 11338
C(CCCCl)CCCl 11341
c1c(cc(c(c1Cl)O)Cl)C(=O)O 11342
c1cc2c(cc(c(c2nc1)O)Cl)Cl 11343
C(#N)C(C#N)(Cl)Cl 11345
C(Cl)Cl 11346
C(Cl)Cl 12405
C(Cl)Cl 16777
C(Cl)Cl 26833
C(Cl)Cl 32660
C(Cl)Cl 32676
C(Cl)Cl 32685
C(Cl)Cl 32787
C(Cl)Cl 34846
C(Cl)Cl 35480
C(Cl)Cl 36423
C(Cl)Cl 40692
C(Cl)Cl 40693
C(Cl)Cl 61005
C(Cl)Cl 61016
C(Cl)Cl 61030
C(Cl)Cl 61093
C(Cl)Cl 37913
C(Cl)Cl 38378
C(Cl)Cl 39070
COC(Cl)Cl 11347
c1ccc2c(c1)C(=O)C(=C(C2=O)Cl)Cl 11348
c1c(cc(c(c1Cl)N)Cl)[N+](=O)[O-] 11349
c1cc(c(c(c1)Cl)Cl)[N+](=O)[O-] 11351
c1cc(c(cc1Cl)Cl)[N+](=O)[O-] 11352
c1cc(c(cc1[N+](=O)[O-])Cl)Cl 11353
C(CCCCCl)CCCCCl 11355
C(CCCl)CCCl 11356
c1cc(c(c(c1)Cl)Cl)O 11357
c1cc(c(cc1Cl)O)Cl 11358
c1cc(c(c(c1)Cl)O)Cl 11359
c1cc(c(cc1O)Cl)Cl 11360
c1c(cc(cc1Cl)Cl)O 11361
c1cc(c(c(c1)Cl)Cl)OCC(=O)O 11362
c1cc(c(cc1Cl)Cl)OCC(=O)O 11363
c1c(c(cc(c1Cl)Cl)N)N 11364
c1ccc(cc1)P(Cl)Cl 11366
CC(CCl)Cl 11367
C(CCl)CCl 11368
C=C(CCl)Cl 11369
c1[nH]c2c(n1)c(nc(n2)Cl)Cl 11370
c1cc(nnc1Cl)Cl 11371
c1cc(c(nc1)Cl)Cl 11372
c1cc(nc(c1)Cl)Cl 11373
c1cc2c(ccnc2cc1Cl)Cl 11375
C=Cc1c(cccc1Cl)Cl 11376
c1cc(sc1Cl)Cl 11377
Cc1cc(ccc1Cl)Cl 11378
Cc1c(cccc1Cl)Cl 11379
C(#N)NC(=N)N 11381
c1cc(ccc1C#N)C#N 11382
C(CCC#N)CC#N 11383
C(/C=C/CC#N)C#N 11384
C(CCCC#N)CCC#N 11386
C(CCC#N)CCC#N 11387
C1CCC(CC1)N=C=NC2CCCCC2 11390
C1CCC(CC1)N=C=NC2CCCCC2 26436
C1CCC(CC1)N=C=NC2CCCCC2 35481
C1CCC(CC1)N=C=NC2CCCCC2 35482
C1CCC(CC1)NC(=O)NC2CCCCC2 11391
CCN(C(C)C)C(C)C 11522
CCN(C(C)C)C(C)C 36784
CCOC(=O)C(C(=O)OCC)NC(=O)C 11393
CCOC(=O)CCC(C(=O)C)C(=O)OCC 11394
CCOC(=O)CC(C(=O)C)C(=O)OCC 11395
CCOC(=O)C(CC=C)C(=O)OCC 11396
CCN(CC)CC(OCC)OCC 11397
CCN(CC)CC(=O)C 11398
CCN(CC)CC#N 11399
CCN(CC)c1ccc(cc1)C=O 11400
CCOP(=O)(Cc1ccc(cc1)N)OCC 11401
CCN(CC)CCS.Cl 11402
CCN(CC)CCCl.Cl 11403
CCOC(=O)C(C(=O)OCC)N.Cl 11404
CCN(CC)c1ccc2c(cc(=O)oc2c1)C 11405
CCN(CC)c1ccc2c(cc(=O)oc2c1)C 40547
CCN(CC)CCCC(=O)C 11406
CCN(CC)CC(C)O 11407
CCN(CC)CCC(=O)O.Cl 11408
CCN(CC)CCCN 11409
CCc1ccc(cc1)CC 11415
CCC.CCc1ccccc1 11416
CCOP(=O)(Cc1ccccc1)OCC 11417
CCOP(=O)(CCBr)OCC 11418
CCOC(=O)C(C(=O)OCC)Br 11419
CCN(CC)C(=O)Cl 11420
CCOC(=O)OCC 11422
CCOC(=O)OCC 22037
CCOP(OCC)Cl 11425
CCOP(=S)(OCC)Cl 11426
CCOP(=O)(CC#N)OCC 11427
CCOC(=O)c1c(c([nH]c1C)C(=O)OCC)C 11428
CCN(CC)C(=S)[S-].[Ag+] 11429
CCN(CC)C(=S)[S-].[Ag+] 41933
C(CNCCN)N 11431
C(CN(CC(=O)O)CC(=O)O)N(CCN(CC(=O)O)CC(=O)O)CC(=O)O 11432
CCN(CC)CCO 11433
CCN(CC)CCO 21985
CCOC=C(C(=O)OCC)C(=O)OCC 11434
CCC(C(=O)OCC)C(=O)OCC 11436
CCOC(=O)C(C(=O)OCC)NC=O 11437
CCOC(=O)/C=C/C(=O)OCC 11438
CCN(CC)O 11442
CCOC(=O)C(=O)C(=O)OCC 11443
CCOC(=O)/C=C\C(=O)OCC 11444
CCOC(=O)CC(=O)OCC 11445
CCN(C)CC 11446
CCN(CC)C(=O)c1cccnc1 11447
CCN(CC)C(=O)C1CCCNC1 11448
CCOP(=O)OCC 11450
CCOC(CP(=O)(OCC)OCC)OCC 11451
CCOC(=O)c1ccccc1C(=O)OCC 11452
CCOC(=O)CCCCCC(=O)OCC 11453
CCC(CC)(CO)CO 11454
CCOC(=O)CCCCCCC(=O)OCC 11455
CCOS(=O)(=O)OCC 11456
CCN(CC)C(=O)c1cccc(c1)C 11457
CCN(CC)C(=O)c1cccc(c1)C 40752
c1cc(c(cc1F)F)N 11459
c1cc(cc(c1)F)F 11460
c1cc(ccc1F)F 11461
c1c(c(cc(c1[N+](=O)[O-])F)F)[N+](=O)[O-] 11462
C(=O)NNC=O 11464
C1C(=O)OC(=O)CO1 11467
c1ccc2c(c1)CCC(=O)O2 11471
c1ccc2c(c1)CCc3ccccc3C2 11472
c1ccc2c(c1)CCc3ccccc3C2O 11473
c1ccc2c(c1)CCc3ccccc3C2=O 11474
c1ccc2c(c1)CCC=C2 11476
c1ccc-2c(c1)CCc3c2cccc3 11477
C1CC=COC1 11478
CC(=O)c1ccc(cc1O)O 11480
CC(=O)c1cc(ccc1O)O 11481
CC(=O)c1c(cccc1O)O 11482
c1cc2c(c(c1)O)C(=O)c3c(cccc3O)C2=O 11483
c1cc(c(cc1O)C=O)O 11484
c1cc(c(cc1C=O)O)O 11485
c1cc(c(cc1O)O)C(=O)O 11487
c1cc(c(c(c1)O)C(=O)O)O 11488
c1cc(c(cc1C(=O)O)O)O 11489
c1c(cc(cc1O)O)C(=O)O 11490
c1cc(ccc1C(=O)c2ccc(cc2)O)O 11492
c1cc(c(cc1/C=C/C(=O)O)O)O 11493
COc1ccc(c(c1)O)C(=O)c2ccc(cc2O)OC 38824
c1c(nc(nc1O)S)O 11496
Cc1cc(nc(n1)O)O 11498
Cc1nc(cc(n1)O)O 11499
c1ccc2cc(c(cc2c1)O)O 11502
c1cc(cc2c1ccc(c2)O)O 11504
Cn1c2c(c(=O)n(c1=O)C)n(cn2)CC(CO)O 11505
c1cc(=O)[nH][nH]c1=O 11506
c1cc(nc(c1)O)O.Cl 11507
c1c(ncnc1O)O 11508
c1cc2c(cc(nc2c(c1)O)C(=O)O)O 11509
c1ccc2c(c1)[nH]c(=O)c(=O)[nH]2 11510
C(CI)I 11514
c1c(cc(c(c1I)N)I)[N+](=O)[O-] 11515
c1c(cc(c(c1C(=O)O)O)I)I 11517
C(CCCN=C=O)CCN=C=O 11519
CC(C)N(CCCl)C(C)C 11520
c1ccc2c(c1)c(ccc2Cl)O 10955
C(CO)NCCO 11392
CC(C)OP(=O)(OC(C)C)F 11523
CC1(O[C@H]2[C@H](O[C@H]3[C@@H]([C@H]2O1)OC(O3)(C)C)CO)C 11524
CC(C)OP(=O)OC(C)C 11526
CCCCCCCCCCCCOP(=O)OCCCCCCCCCCCC 11529
C(C(CS)S)O 11530
c1(nnc(s1)S)S 11531
CC(=O)c1cc(ccc1OC)OC 11534
COc1ccc(c(c1)OC)N 11535
COc1cc(cc(c1)OC)N 11536
COc1cccc(c1OC)C=O 11537
COc1ccc(c(c1)OC)C=O 11538
COc1ccc(c(c1)C=O)OC 11539
COc1cc(cc(c1)OC)C(=O)N 11540
COc1ccc(cc1)OC 11541
COc1cccc(c1OC)C(=O)O 11542
COc1ccc(c(c1)OC)C(=O)O 11543
COc1cccc(c1C(=O)O)OC 11544
COc1ccc(cc1OC)C(=O)O 11545
COc1cc(cc(c1)OC)C(=O)O 11546
COc1ccc(cc1OC)C#N 11547
COc1cc(cc(c1)OC)C#N 11548
COc1ccc(cc1OC)CO 11549
COc1ccc(cc1OC)/C=C/C(=O)O 11551
COc1cc(cc(c1)OC)/C=C/C(=O)O 11552
CC(=O)c1cc(c(c(c1)OC)O)OC 11554
COc1cc(cc(c1O)OC)/C=C/C(=O)O 11555
COCOC 11556
COc1cccc(c1O)OC 11559
COc1cccc(c1O)OC 38037
COc1ccc(c(c1)CC(=O)O)OC 11560
COc1ccc(cc1OC)CC(=O)O 11561
COc1ccc(cc1OC)CCN 11562
CC(C)(OC)OC 11563
COc1cccc(n1)OC 11565
COc1ccc(cc1)/C=C/c2ccc(cc2)OC 11566
COC1CCC(O1)OC 11567
Cc1c(cccc1OC)OC 11568
CC(=O)N(C)C 11569
CC(=O)N(C)C 16778
CC(=O)N(C)C 18107
CC(=O)N(C)C 61031
CC(=O)N(C)C 37871
CC(=O)N(C)C 39067
CC(=O)N(C)C 39080
CC(=O)N(C)C 39635
CC(=O)N(C)C 37523
COC(=O)CC(=O)CC(=O)OC 11570
COC(=O)C#CC(=O)OC 11571
Cc1c(c(=O)n(n1C)c2ccccc2)N(C)C 11574
CN(C)c1cccc(c1)C(=O)O 11575
CN(C)c1ccc(cc1)C(=O)O 11576
CN(C)c1ccc(cc1)C#N 11578
CN(C)c1ccc(cc1)/C=C/C=O 11579
CN(C)CCS.Cl 11581
CN(C)CCCl.Cl 11582
CC(CN(C)C)Cl.Cl 11583
CN(C)Cc1c(cccn1)O 11584
CN(C)c1cccc2c1cccc2S(=O)(=O)Cl 11585
CN(C)c1cccc(c1)O 11586
CC(CN(C)C)O 11587
CN(C)CCCO 11588
CN(C)CCC(=O)c1ccccc1 11589
CN(C)CCCN 11590
CN(C)CCCN 21986
CN(C)CCCCl.Cl 11591
CN(C)c1ccccc1 11592
Cc1cccc(c1C)N 11593
Cc1cccc(c1N)C 11594
Cc1cc(cc(c1)OC)C 11596
Cc1c2ccccc2c(c3c1cccc3)C 11597
Cc1cc2c(cc1C)nc[nH]2 11598
Cc1ccc(cc1C)C(=O)O 11599
Cc1cc(cc(c1)C(=O)O)C 11600
Cc1ccc(c(c1)C)C(=O)c2ccccc2 11601
CC1=CC(=O)C=C(C1=O)C 11604
Cc1cc2c(cc1C)nn[nH]2 11605
Cc1ccc2c(c1)nc(o2)C 11606
Cc1ccc(cc1)c2ccc(cc2)C 11608
CCC(C)(C)C 11609
CC(C)C(C)C 11610
COC(=O)OC 11612
COP(=S)(OC)Cl 11613
CC1CCCCC1C 11614
CC1(CC(=O)CC(=O)C1)C 11615
CC1CC(=CC(=O)C1)C 11616
CN(C)CCO 11618
CNCCNC 11619
CN(C)CCN 11620
CCc1c(c[nH]c1C)C 11621
CN(C)C=O 11622
CN(C)C=O 16779
CN(C)C=O 21058
CN(C)C=O 27960
CN(C)C=O 32687
CN(C)C=O 32717
CN(C)C=O 34843
CN(C)C=O 35483
CN(C)C=O 40831
CN(C)C=O 40832
CN(C)C=O 42364
CN(C)C=O 61032
CN(C)C=O 61094
COC(=O)CCCC(=O)OC 11623
CC(C)(CC(=O)O)CC(=O)O 11624
CC1(CCC(=O)OC1=O)C 11625
CC1(CC(=O)OC(=O)C1)C 11626
CC1(CC(=O)NC(=O)C1)C 11627
CC(=CC=C(C)C)C 11628
CC(C)CCCC(C)N 11630
CC1(C(=O)NC(=O)N1)C 11631
CN(C)N 11632
CNNC.Cl.Cl 11633
CNOC.Cl 11634
Cc1cc(nc(n1)C)O 11635
Cc1cc(on1)C 11638
CC1=C(C(=O)OC1=O)C 11639
CN(C)CCc1c[nH]c2c1cc(cc2)OC 11641
CN(C)c1cccc(c1)[N+](=O)[O-] 11647
Cc1cc(c(cc1C)[N+](=O)[O-])N 11648
CN(C)c1ccc(cc1)N=O 11649
CCC(C)C(C)C 11650
CCC(C(C)(C)C)O 11651
Cc1cccc(c1C)O 11652
Cc1ccc(c(c1)O)C 11654
Cc1ccc(c(c1)O)C 11655
Cc1cccc(c1O)C 11657
Cc1ccc(cc1C)O 11658
Cc1cc(cc(c1)O)C 11660
Cc1cc(cc(c1)O)C 16279
C[N+]1(CCN(CC1)c2ccccc2)C.[I-] 11662
COC(=O)c1ccccc1C(=O)OC 11664
COC(=O)c1ccccc1C(=O)OC 22038
CN1CCN(CC1)C 11665
CC1CNC(CN1)C 11666
CC1CCCC(N1)C 11668
Cc1cncc(n1)C 11669
Cc1cc(n[nH]1)C 11670
Cc1cc(n(n1)C(=O)N)C 11671
Cc1cc(ncn1)C 11673
Cc1cc(=O)cc(o1)C 11674
CC1CCC(N1)C 37110
Cc1c(nc2ccccc2n1)C 11678
CC(C)(CC(=O)O)C(=O)O 11679
CC(C(C)C(=O)O)C(=O)O 11680
CN(C)S(=O)(=O)Cl 11681
CN(C)S(=O)(=O)Cl 40859
COS(=O)(=O)OC 11682
Cc1nnc(s1)C 11685
Cc1csc(n1)C 11686
Cc1ccc(s1)C 11688
CNC(=S)NC 11689
Cc1ccc(cc1)N(C)C 11690
CNC(=O)NC 11691
c1cc(c(cc1[N+](=O)[O-])[N+](=O)[O-])N 11693
c1cc(cc(c1)[N+](=O)[O-])[N+](=O)[O-] 11697
c1cc(c(cc1[N+](=O)[O-])[N+](=O)[O-])F 11703
c1cc(c(cc1[N+](=O)[O-])[N+](=O)[O-])NN 11706
CCCCCCCCNCCCCCCCC 11708
CCCCCCCCNCCCCCCCC 40879
CCCCC(CC)COC(=O)c1ccccc1C(=O)OCC(CC)CCCC 11709
CCCCC(CC)COC(=O)c1ccccc1C(=O)OCC(CC)CCCC 33914
CCCCC(CC)COC(=O)CC(C(=O)OCC(CC)CCCC)S(=O)(=O)[O-].[Na+] 11710
C1COCCO1 11711
C1COCCO1 16780
C1COCCO1 26834
C1COCCO1 27049
C1COCCO1 32689
C1COCCO1 36434
C1COCCO1 40882
C1COCCO1 61033
C1COCCO1 61512
C(C(CO)(CO)COCC(CO)(CO)CO)O 11712
c1ccc(cc1)C(c2ccccc2)C(=O)O 11715
CC(=O)C(c1ccccc1)c2ccccc2 11716
c1ccc(cc1)CC(=O)Cc2ccccc2 11717
c1ccc(cc1)C#Cc2ccccc2 11718
c1ccc(cc1)c2c3ccccc3c(c4c2cccc4)c5ccccc5 11720
c1ccc(cc1)Nc2ccc(cc2)c3ccc(cc3)Nc4ccccc4 11721
c1ccc(cc1)/C=C/C=C/c2ccccc2 40935
c1ccc(cc1)OC(=O)Oc2ccccc2 11723
c1ccc(cc1)OP(=O)(Oc2ccccc2)Cl 11724
c1ccc(cc1)C(CN)c2ccccc2 11725
C=C(c1ccccc1)c2ccccc2 11726
c1ccc(cc1)NC(=N)Nc2ccccc2 11729
c1ccc(cc1)/C=C/C=C/C=C/c2ccccc2 11730
c1ccc(cc1)/C=C/C=C/C=C/c2ccccc2 40936
c1ccc(cc1)c2c(nc[nH]2)c3ccccc3 11731
c1ccc(cc1)C2=C(C(=O)c3c2cccc3)c4ccccc4 11732
c1ccc(cc1)I(c2ccccc2)Cl 11733
c1ccc(cc1)Cc2ccccc2 11735
c1ccc(cc1)Cc2ccccc2 21988
c1ccc(cc1)c2nnc(o2)c3ccccc3 11737
c1ccc(cc1)c2cnc(o2)c3ccccc3 11738
c1ccc(cc1)OP(=O)Oc2ccccc2 11739
CC(c1ccccc1)(c2ccccc2)C(=O)O 11741
c1ccc(cc1)C(CC(=O)O)c2ccccc2 11742
c1ccc(cc1)C(c2ccccc2)c3ccccn3 38794
c1ccc(cc1)[Si](c2ccccc2)(O)O 32506
CCCNCCC 11749
c1ccnc(c1)c2ccccn2 11750
c1ccc(c(c1)C(=O)O)SSc2ccccc2C(=O)O 11756
Cc1ccc(cc1)C(=O)OC(C(C(=O)O)OC(=O)c2ccc(cc2)C)C(=O)O 11757
CCCCCCCCCCCC 11759
CCCCCCCCCCCC 40922
C(CCCCCCC(=O)O)CCCCCC(=O)O 11760
CCCCCCCCCCCCS 11762
CCCCCCCCCCCCS 40923
CCCCCCCCCCC=C 11763
CCCCCCCCC/C=C/CC1CC(=O)OC1=O 11764
CCCCCCCCCCCCN 11766
CCCCCCCCCCCCSCCCCCCCCCCCC 11768
CCCCCCCCCCCCCCCCCCCCCCCCCCCCCCCC 11769
C([C@@H]([C@H]([C@H]([C@@H](CO)O)O)O)O)O 11770
CC1=C(C(=O)C(=C(C1=O)C)C)C 11771
CCCCCCCCCCCCCCCCCCCC(=O)O 11772
c1c2c3c4c(cc(c(c4oc2=O)O)O)c(=O)oc3c(c1O)O 11774
Cc1cc2c(c(c1)O)C(=O)c3c(cc(cc3O)O)C2=O 11775
C1C(O1)CCl 11778
C1C(O1)CF 11779
CC(C)[C@@H](C)/C=C/[C@@H](C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3C2=CC=C4[C@@]3(CC[C@@H](C4)O)C)C 11781
C([C@H]([C@H](CO)O)O)O 11782
c1cc(=O)oc2c1cc(c(c2)O)O[C@H]3[C@@H]([C@H]([C@@H]([C@H](O3)CO)O)O)O 11783
C[C@]12CC[C@@H]3c4ccc(cc4CC[C@H]3[C@@H]1CCC2=O)O 11784
CCS 11786
CCOc1ccccc1C(=O)N 11787
CCOC1=CC(=O)CCC1 11788
CCOCCOCCO 11789
CCOCCOCCOCC 11790
CCOc1ccc(cc1OC)C=O 11791
CCOC=C(C#N)C#N 11792
CCOCCC(OCC)OCC 11794
CCOC(=O)CC(=O)C 11797
CCOC(=O)CC(=O)C 22040
CCOC(=O)C=C 11798
CCOC(=O)c1cccc(c1)N 11799
CCOC(=O)c1cccc(c1)N.CS(=O)(=O)O 11800
CCOC(=O)/C=C(\C)/N 11803
CCNc1ccccc1 11804
CCc1ccccc1N 11805
CCc1ccc(cc1)N 11806
CCc1ccc2c(c1)C(=O)c3ccccc3C2=O 11807
CCc1ccccc1 11808
CCOC(=O)c1ccccc1 11809
CCOC(=O)C(Cc1ccccc1)C(=O)C 11810
CCC(C(=O)OCC)Br 11811
CCOC(=O)/C=C/CBr 11812
CCOC(=O)C(C)(C)Br 11813
CCOC(=O)C(C)Br 11814
CCOC(=O)C(=O)CBr 11815
CCCC(C(=O)OCC)Br 11816
CCC(CC)CO 11817
CCCC(=O)OCC 11818
CCCC(=O)CC(=O)OCC 11819
CCOC(=O)NN 11820
CCn1c2ccccc2c3c1cccc3 11821
CCOC(=O)CCl 11822
CCOC(=O)CCl 22041
CCOC(=O)C(C(=O)C)Cl 37631
CCOC(=O)CCCCl 11824
CCOC(=O)Cl 11825
CCOC(=O)Cl 18108
CCOC(=O)CCCl 11826
CCOC(=O)CCCl 40985
CCOC(=O)CC#N 11828
CCOC(=O)c1ccc(cc1)C#N 11829
CCOC(=O)C#N 11830
CCC1CCCCC1 11831
CCOC(=O)C1CCCCC1=O 11833
CCOC(=O)CC1CCCCC1 11834
CCOC(=O)C1CC1 11835
CCOC(=O)C(CBr)Br 11837
CCOP(=O)(Cl)Cl 11838
CCOC(=O)c1ccc(cc1)N(C)C 11840
C1COC(=O)O1 11841
C(CN)N 11842
C(CN)N 22042
C(CN(CC(=O)O)CC(=O)O)N(CC(=O)O)CC(=O)O 11843
C(CN(CC(=O)O)CC(=O)O)N(CC(=O)O)CC(=O)O 40993
C(CN(CC(=O)[O-])CC(=O)[O-])N(CC(=O)[O-])CC(=O)[O-].[Na+].[Na+].[Na+].[Na+] 11844
C(CN(CC(=O)[O-])CC(=O)[O-])N(CC(=O)[O-])CC(=O)[O-].[Na+].[Na+].[Na+].[Na+] 40999
COCCOC 11845
COCCOC 61035
CCO/C=C(\C#N)/C(=O)OCC 11848
CCC(C#C)O 11849
CCCC(C(CC)CO)O 11851
CCCCC(CC)C(=O)O 11852
CCCCC(CC)C(=O)O 22043
CCCCC(CC)CO 11853
CCOC(=O)CC(C)O 11854
CCSCCO 11855
CCOC(=O)C(C)(C)O 11856
CCOC(=O)c1c([nH]c2c1cc(cc2)O)C 11857
CCN1CCCC(C1)O 11858
CCOC(=O)c1cc2ccccc2[nH]1 11860
CCOC(=O)CC(=O)C(C)C 38344
CCOC(=O)c1c(cc(=O)oc1C)C 37390
CCOC(=O)C1CCNCC1 11864
CCN=C=S 37686
CCOC(=O)[C@H](C)O 11866
CCOC(=O)[C@H](C)O 41016
CCOC(=O)[C@H](C)O 41017
CCOC(=O)CS 11867
CC[Hg]Sc1ccccc1C(=O)[O-].[Na+] 11868
CCOC(=O)C(C)C(=O)C 32611
CCc1[nH]cc(n1)C 11871
CCOC(=O)c1cccnc1 11874
CCc1ccc(cc1)[N+](=O)[O-] 11875
CCOC(=O)CC(=O)c1ccc(cc1)[N+](=O)[O-] 11876
CCOC(=O)C(=O)Cl 11878
CCOC(=O)C(=O)N 11879
CCc1ccccc1O 11880
CCc1cccc(c1)O 11881
CCc1ccc(cc1)O 11882
CCOC(=O)C(C#N)c1ccccc1 11883
CCOC(=O)C#Cc1ccccc1 11885
CCOC(=O)c1ccccn1 11886
CCOC(=O)N1CCNCC1 11887
CCN1CCCCC1 11888
CCOC(=O)C#C 11890
CCOC(=O)Cc1ccccn1 11891
CCOC(=O)Cc1cccnc1 11892
CCOC(=O)C(=O)C 11894
CCc1ccc(cc1O)O 11895
CCc1cccs1 11896
CCOC(=O)c1cccs1 11897
CCNC(=S)NN 11898
CCc1ccccc1C 11899
CCc1ccc(cc1)C 11901
CCOC(=O)C(F)(F)F 11902
CCOC(=O)CC(=O)C(F)(F)F 11903
CC[P+](c1ccccc1)(c2ccccc2)c3ccccc3.[Br-] 11904
CCNC(=O)N 11906
CCOC=C 11908
CCC(=O)C=C 11909
C#CC1(CCCCC1)O 11910
COc1cc(ccc1O)CC=C 11911
CC(=CCC/C(=C/CC/C(=C/CO)/C)/C)C 11912
CC1=O[Fe+3]23(O=C([CH-]1)C)(O=C([CH-]C(=O2)C)C)O=C([CH-]C(=O3)C)C 11913
[C@@H]12C3[Fe]1456789(C2C4[C@H]53)C1C6[C@H]7C8[C@H]91 11914
c1cc(c(cc1c2c(c(=O)c3ccc(cc3o2)O)O)O)O 11915
c1ccc(cc1)c2cc(=O)c3ccccc3o2 11916
c1ccc-2c(c1)-c3cccc4c3c2ccc4 11917
c1ccc-2c(c1)-c3cccc4c3c2ccc4 34598
c1ccc2c(c1)-c3ccccc3C2C(=O)O 11919
c1ccc2c(c1)-c3ccccc3C2=O 11920
c1ccc2c(c1)-c3ccc(cc3C2=O)C(=O)O 11921
c1ccc2c(c1)C(=O)OC23c4ccc(cc4Oc5c3ccc(c5)O)O 11924
c1ccc2c(c1)C(=O)OC23c4ccc(cc4Oc5c3ccc(c5)O)O 41062
c1cc2c(cc1N=C=S)C(=O)OC23c4ccc(cc4Oc5c3ccc(c5)O)O 11925
CC(=O)c1ccc(cc1)F 11926
c1ccc(c(c1)N)F 11927
c1cc(cc(c1)F)N 11928
c1cc(ccc1N)F 11929
COc1ccccc1F 11930
COc1ccc(cc1)F 11931
c1ccc(c(c1)C=O)F 11932
c1cc(cc(c1)F)C=O 11933
c1ccc(cc1)F 11934
c1cc(ccc1F)S(=O)(=O)Cl 11935
c1ccc(c(c1)C(=O)O)F 11936
c1cc(cc(c1)F)C(=O)O 11937
c1ccc(cc1)C(=O)c2ccc(cc2)F 11938
c1cc(ccc1CO)F 11939
c1cc(cc(c1)F)CBr 11940
c1ccc(c(c1)CCl)F 11941
c1cc(cc(c1)F)CCl 11942
c1cc(ccc1CCl)F 11943
c1ccc(cc1)c2ccc(cc2)F 11944
Cc1ccc(cc1F)C(=O)O 11947
c1ccc(c(c1)[N+](=O)[O-])F 11948
c1cc(ccc1[N+](=O)[O-])F 11949
Cc1cc(ccc1F)[N+](=O)[O-] 11951
Cc1ccc(cc1[N+](=O)[O-])F 11952
Cc1cc(ccc1[N+](=O)[O-])F 11953
c1ccc(c(c1)O)F 11954
c1cc(cc(c1)F)O 11955
c1cc(ccc1O)F 11956
c1cc(ccc1CC(=O)O)F 11957
c1cc(ccc1CC(C(=O)O)N)F 11958
c1cc(ccc1NN)F.Cl 11959
c1cc(ccc1N=C=O)F 11960
c1cc(ccc1F)S(=O)(=O)c2ccc(cc2)F 11962
c1ccnc(c1)F 11963
c1cc(ccc1F)S 11965
Cc1ccccc1F 11966
Cc1ccc(cc1)F 11967
c1cc2c(cc1F)c(c[nH]2)CC(C(=O)O)N 11968
C=O 11969
C=O 41073
CC(=O)O.C(=N)N 11971
C(=N)(N)S(=O)O 11972
C1CCN(CC1)C=O 11973
c1cc(c(cc1C=O)C(=O)O)O 11974
C(=C/C(=O)O)\C(=O)O 11975
C(=C/C(=O)O)\C(=O)O 22044
c1ccoc1 11977
c1ccoc1 18111
c1cc(oc1)CO 11979
c1cc(oc1)CO 18112
c1cc(oc1)CN 11980
c1cc(oc1)CS 11981
c1cc(oc1)C(=O)O 11982
c1cc(oc1)/C=C/C(=O)O 11984
CC(C)(C)c1cc(cc(c1[O])C(C)(C)C)C=C2C=C(C(=O)C(=C2)C(C)(C)C)C(C)(C)C 11985
C[C@@]12[C@H](C=C[C@@]3([C@@H]1[C@@H]([C@]45[C@H]3CC[C@](C4)(C(=C)C5)O)C(=O)O)OC2=O)O 11986
C[C@@]12[C@H](C=C[C@@]3([C@@H]1[C@@H]([C@]45[C@H]3CC[C@](C4)(C(=C)C5)O)C(=O)O)OC2=O)O 41091
C[C@@]12[C@H](C=C[C@@]3([C@@H]1[C@@H]([C@]45[C@H]3CC[C@](C4)(C(=C)C5)O)C(=O)O)OC2=O)O 41092
C[N+](C)(C)CC(=O)NN.[Cl-] 11987
C[C@]12CC[C@@H](C[C@H]1CC[C@@H]3[C@@H]2CC[C@]4([C@@]3(C[C@@H]([C@@H]4C5=CC(=O)OC5)O)O)C)O 11988
C([C@H]([C@H]([C@@H]([C@H](C(=O)O)O)O)O)O)O 11989
C([C@@H]1[C@H]([C@@H]([C@H](C(O1)O)N)O)O)O.Cl 11990
CC(=O)OC[C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C 11991
C(CC(=O)O)C(C(=O)O)N 11993
C(CC(=O)O)[C@@H](C(=O)[O-])N.O.[Na+] 11994
C(CC(=O)N)[C@@H](C(=O)O)N 11995
C(CC(=O)O)CC(=O)O 11996
C1CC(=O)OC(=O)C1 11997
C1CC(=O)OC(=O)C1 38804
C(CC=O)CC=O 41096
C(CC=O)CC=O 41097
C(CC=O)CC=O 11998
C(CC=O)CC=O 23328
C(CC=O)CC=O 32605
C(CC(=O)Cl)CC(=O)Cl 11999
C(CC(=O)N[C@@H](CS)C(=O)NCC(=O)O)[C@@H](C(=O)O)N 12000
C1C(O1)CO 12005
C(C(=O)N)N.Cl 12006
C(C(=O)O)N 12007
C(C(=O)O)N 22091
C1C(=O)NCC(=O)N1 12008
CCOC(=O)CN.Cl 12009
COC(=O)CN.Cl 12010
C1COS(=O)O1 12012
C12C(NC(=O)N1)NC(=O)N2 12013
C(C(=O)NCC(=O)O)N 12014
CC1([C@@H]2CC[C@@]3([C@@H]([C@]2(CC[C@@H]1O)C)C(=O)C=C4[C@]3(CC[C@@]5([C@H]4C[C@@](CC5)(C)C(=O)O)C)C)C)C 12015
c1ccc(c(c1)N=CC=Nc2ccccc2O)O 12016
C(C(=O)O)(O)O 12017
CN(C)Cc1c[nH]c2c1cccc2 12018
COc1ccccc1O 12019
Cc1ccc(cc-2c(ccc12)C)C(C)C 12020
C(C(=O)O)NC(=N)N 12021
C(=N)(N)N.C(=N)(N)N.C(=O)(O)O 12022
C(=N)(N)N.Cl 12023
C(=N)(N)N.Cl 17577
C(=N)(N)N.Cl 36479
c1[nH]c2c(n1)c(=O)[nH]c(n2)N 12025
c1nc2c(=O)[nH]c(nc2n1[C@H]3[C@@H]([C@@H]([C@H](O3)CO)O)O)N 12026
c1nc2c(=O)[nH]c(nc2n1[C@H]3[C@@H]([C@@H]([C@H](O3)CO)O)O)N 41113
CC1=NCCc2c1[nH]c3c2ccc(c3)O.Cl 12028
CCCCCCC=O 12032
CCCCCCC 12034
CCCCCCC 32669
CCCCCCC 32677
CCCCCCC 32691
CCCCCCC 36436
CCCCCCC 36497
CCCCCCC 41124
CCCCCCC 41125
CCCCCCC 61036
CCCCCCC 38379
CCCCCCC 38917
C(CCCO)CCCO 12035
CCCCCCCO 12036
CCCCCC(C)O 12037
CCCCC(=O)CC 12038
C(=O)(C(Cl)(Cl)Cl)C(Cl)(Cl)Cl 12042
C(=C(Cl)Cl)(C(Cl)(Cl)Cl)Cl 12045
CCCCCCCCCCCCCCCC 12046
CCCCCCCCCCCCCCCCS(=O)(=O)Cl 12047
CCCCCCCCCCCCCCCCO 12048
CCCCCCCCCCCCCCCCO 41136
CCCCCCCCCCCCCCC(C)O 12049
CCCCCCCCCCCCCCC=C 12050
CCCCCCCCCCCCCCCCN 12051
CCCCCCCCCCCCCCCCS 12052
C/C=C/C=C/C(=O)O 12053
c1(c(c(c(c(c1F)F)F)F)F)F 12054
Cc1c(c(c(c(c1C)C)C)C)C 12057
C[Si](C)(C)N[Si](C)(C)C 12058
C1CCCNCC1 12059
C1N2CN3CN1CN(C2)C3 12061
C1N2CN3CN1CN(C2)C3 23289
C(CCCN)CCN 12064
C(CCCN)CCN 41156
C(CCCO)CCO 12065
C(CCCS)CCS 12067
CCCCCC(=O)O 12070
CCCCCC(=O)O 41164
CCCC(CC)O 12071
CCCCCC(=O)c1ccccc1 12072
CCCC(C=C)O 12076
CC/C=C\CCO 12077
CC(=O)CCC=C 12078
CCCCCCO 12079
CCCCCCO 41165
CCCCCCSCCCCCC 12080
c1c(nc[nH]1)C[C@@H](C(=O)O)N.O.Cl 41173
COC(=O)[C@H](Cc1c[nH]cn1)N.Cl.Cl 12082
C1CSC(=O)C1N.Cl 12083
c1ccc(c(c1)CC(=O)O)C(=O)O 12084
C1CNCCNC1 12085
c1cc(ccc1O)O 12091
c1cc(ccc1O)O 21993
CC(=O)c1ccccc1O 12093
c1cc(cc(c1)O)C=O 12096
c1ccc2c(c1)[nH]c(n2)O 12097
c1cc(cc(c1)O)C(=O)O 12098
c1cc(ccc1C(=O)O)O 12099
c1cc(ccc1C(=O)NN)O 12100
c1ccc(cc1)C(=O)c2ccc(cc2)O 12101
c1cc(cc(c1)O)CO 12102
c1cc(ccc1CO)O 12103
c1cc(ccc1CC#N)O 12104
CC(CC(=O)O)O 12105
c1ccc(c(c1)/C=C/C(=O)O)O 12107
c1cc(cc(c1)O)/C=C/C(=O)O 12108
c1cc(ccc1/C=C/C(=O)O)O 12109
c1ccc2c(c1)c(cc(=O)o2)O 12110
c1cc(cc2c1ccc(=O)o2)O 12111
c1ccc(cc1)Cc2ccc(cc2)O 12113
CC(c1cccc(c1)N)O 12115
C(COCCO)O 12116
C(CN(CC(=O)O)CC(=O)O)N(CCO)CC(=O)O 12117
C1COCCN1CCO 12118
C1CN(CCN1)CCO 12119
C1CCN(C1)CCO 12120
c1ccc(cc1)[P+](CCO)(c2ccccc2)c3ccccc3.[Cl-] 12122
c1ccc2c(c1)-c3ccccc3C2O 12123
c1ccc2c(c1)-c3cccc(c3C2=O)O 12124
c1ccc2c(c1)-c3ccc(cc3C2=O)O 12125
c1cc2c(cc[nH]2)cc1O 12127
c1cc2c(cc1O)c(c[nH]2)CC(=O)O 12128
c1cc2cnccc2c(c1)O 12129
Cc1cc(nc(n1)S)O 12130
CCCc1cc(nc(n1)S)O 12131
CC(=O)c1ccc(cc1O)OC 12133
COc1cccc2c1nc3ccccc3c2O 12134
COc1cc(ccc1O)C(=O)O 12135
COc1ccc(c(c1)O)C(=O)c2ccccc2 12136
COc1cc(ccc1O)CN.Cl 12137
Cc1ccc(c(c1)C(=O)C)O 12138
Cc1cc(ccc1C(=O)C)O 12139
Cc1cc(ccc1O)C(=O)C 12140
c1ccc2c(c1)OCC(O2)CO 12141
Cc1ccc(cc1O)C(=O)O 12142
Cc1ccc(c(c1)C(=O)c2ccccc2)O 12143
CC(=O)C(C)(C)O 12144
c1cc(oc1CO)C=O 12146
CC(=O)CC(C)(C)O 12148
c1ccc2c(c1)C(=O)N(C2=O)CO 12149
CN1CCC(CC1)O 12151
C[C@H]1C[C@H]2[C@@H]3CC=C4C[C@H](CC[C@@]4([C@H]3CC[C@@]2([C@]1(C(=O)C)O)C)C)O 12152
Cc1ccc(c(n1)O)C(=O)O 12153
Cc1ccnc(n1)O.Cl 12154
Cc1c(c(=O)cco1)O 12155
Cc1cc(cc(=O)o1)O 12156
Cc1cc(nc2c1cccc2)O 12157
Cc1cc(c2ccccc2n1)O 12158
c1ccc2c(c1)ccc(c2C=O)O 12160
c1ccc2cc(c(cc2c1)C(=O)O)O 12161
c1ccc2cc(c(cc2c1)C(=O)NN)O 12162
c1ccc2c(c1)C(=O)C=C(C2=O)O 12163
c1ccc2c(c1)C(=O)C=C(C2=O)O 18001
c1cc2c(c(c1)O)C(=O)C=CC2=O 12164
c1cc(c(cc1[As](=O)(O)O)[N+](=O)[O-])O 12166
c1cc(c(cc1C(=O)O)O)[N+](=O)[O-] 12167
c1cc(ncc1[N+](=O)[O-])O 12168
c1ccc(c(c1)CC(=O)O)O 12169
c1cc(cc(c1)O)CC(=O)O 12170
c1cc(ccc1CC(=O)O)O 12171
c1ccc(c(c1)c2nc3ccccc3o2)O 12172
c1cc(ccc1NCC(=O)O)O 12173
c1cc(ccc1CCC(=O)O)O 12175
CC(=O)[C@H]1CC[C@@H]2[C@@]1(C[C@H]([C@H]3[C@H]2CCC4=CC(=O)CC[C@]34C)O)C 12177
C1[C@H](CN[C@@H]1C(=O)O)O 12178
CCC(=O)c1ccccc1O 12180
CCC(=O)c1ccc(cc1)O 12181
c1c2c([nH]n1)ncnc2O 12183
c1ccnc(c1)O 12184
c1cc(cnc1)O 12185
c1cnc(nc1)O.Cl 12186
Cc1ccc2cccc(c2n1)O 12187
c1ccc2c(c1)c(ncn2)O 12188
c1ccc2c(c1)c(ccn2)O 12189
c1cc2cccnc2c(c1)O 42424
c1cc2cccnc2c(c1)O 12190
c1ccc(cc1)/C=C/c2ccc(cc2)O 12193
C1COCC1O 12194
c1(c(nc(nc1O)N)N)N.OS(=O)(=O)O 12196
CC(=CCC/C(=C/CCC(C)(C=C)O)/C)C 12197
c1cc(c(cc1CCN)O)O.Cl 12200
c1[nH]c2c(n1)c(ncn2)O 12201
c1cnc[nH]1 12202
c1cnc[nH]1 30187
C1CNC(=S)N1 12203
C(CN)CNCCCN 12205
C(C(=O)[O-])NCC(=O)[O-].O.[Na+].[Na+] 12206
C(C(=O)[O-])NCC(=O)[O-].O.[Na+].[Na+] 41228
c1ccc2c(c1)CCc3ccccc3N2 12207
c1ccc2c(c1)C(=O)CC2=O 12209
c1cc2c(cc1O)CCC2 12210
c1ccc2c(c1)CCC2=O 12211
c1ccc2c(c1)cn[nH]2 12212
c1ccc2c(c1)c(=O)[nH][nH]2 12213
c1ccc2c(c1)CC=C2 12214
c1ccc2c(c1)cc[nH]2 12215
c1ccc2c(c1)c(c[nH]2)CC(=O)O 12216
c1ccc2c(c1)c(c[nH]2)CC(=O)NN 12217
c1ccc2c(c1)c(c[nH]2)/C=C/C(=O)O 12218
c1ccc2c(c1)c(c[nH]2)CO 12219
c1ccc2c(c1)cc([nH]2)C(=O)O 12220
c1cc2c(cc[nH]2)cc1C(=O)O 12221
c1ccc2c(c1)CCN2 12224
c1[nH]c(=O)c2c(n1)n(cn2)[C@H]3[C@@H]([C@@H]([C@H](O3)CO)O)O 12225
[C@@H]1([C@@H]([C@H]([C@@H]([C@H]([C@H]1O)O)O)O)O)O 12226
C(C(=O)N)I 12227
C(C(=O)O)I 12228
C(C#N)I 12229
c1ccc(c(c1)N)I 12230
c1cc(cc(c1)I)N 12231
COc1ccc(cc1)I 12232
c1ccc(cc1)I 12233
c1ccc(c(c1)C(=O)O)I 12234
c1c(c(=O)[nH]c(=O)n1[C@H]2C[C@@H]([C@H](O2)CO)O)I 12235
CI 12237
CI 37841
c1cc(ccc1[N+](=O)[O-])I 12238
c1cc(ccc1O)I 12239
c1ccc(cc1)c2nn([n+](n2)c3ccc(cc3)[N+](=O)[O-])c4ccc(cc4)I.[Cl-] 12240
C(CI)C(=O)O 12241
c1cc(c(cc1I)C(=O)O)O 12242
Cc1ccccc1I 12243
c1cc(c(cc1C[C@@H](C(=O)O)N)I)O 12244
c1ccc2c(c1)c(=O)oc(=O)[nH]2 12248
CC1(C2CCC1(C(C2)O)C)C 12249
CC(C)C=O 12251
CC(C)C(=O)O 12252
CC(C)C(=O)O 21996
CC(C)C#N 12253
c1ccc2c(c1)CCOC2 12254
C/C=C\c1ccc(c(c1)OC)O 12257
c1cnccc1C(=O)N 12258
c1cnccc1C(=O)O 12259
c1cnccc1C(=O)NN 12260
C1CNCCC1C(=O)N 12261
C1CNCCC1C(=O)O 12262
CC1=CC(=O)CC(C1)(C)C 12264
c1cc(cc(c1)C(=O)O)C(=O)O 12265
c1cc(cc(c1)C(=O)Cl)C(=O)Cl 12266
CC(=C)C=C 12267
CC(C)C1CCCCC1 12269
CC(C)SSC(C)C 12270
CC(C)NCCN 12271
CC1(O[C@@H]2[C@H](O[C@H]([C@@H]2O1)n3cnc4c3ncnc4N)CO)C 12272
CC1(O[C@@H]2[C@H]([C@H](O[C@@H]2O1)C(CO)O)O)C 12273
CC1(O[C@@H]2[C@H](O[C@H]([C@@H]2O1)n3ccc(=O)[nH]c3=O)CO)C 12274
C=C(CC(=O)O)C(=O)O 12281
c1cc2c3c(c1)CCCN3CCC2 12283
CCC(=O)C(=O)O 12284
CC(C)CCC[C@@H](C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC(=O)[C@@H]4[C@@]3(CC[C@@H](C4)O)C)C 12285
C(CC(=O)O)C(=O)C(=O)O 12286
C(CC(=O)O)C(=O)CCC(=O)O 12288
c1cc(c(cc1Cl)Cl)C(Cn2ccnc2)O 12291
Cc1ccc(cc1)S(=O)(=O)O.c1ccc(cc1)C2(CCNCC2)C(=O)O 12292
c1ccc(cc1)C(c2ccccc2)N3CCNCC3 12293
CC1(CN(NC1=O)c2ccccc2)CO 12294
CC1(CN(NC1=O)c2ccccc2)C 12295
c1cc(ccc1CCN)S(=O)(=O)N.Cl 12296
C1C2C(C(C1Cl)CC2=O)CO 12301
CCOC(=O)CC1CCCC1=O 12304
CCOC(=O)CCCCCC1CCCC1=O 12306
c1cc2c(cc1N)N3CCN=C3S2 12308
COc1ccc(cc1)CCCl 12311
c1cc2cc[nH]c2c(c1)[N+](=O)[O-] 12314
Cc1cccc2c1[nH]c(c2C)C 12316
Br 12317
Br 12318
Br 22332
Br 42378
CCN(CC)CCC#N 12319
C[C@@H]([C@@H](c1ccccc1)O)NC.Cl 12320
c1cc2c(cc[nH]2)c(c1)Cl 12323
CC(=O)[O-].O.O.O.[Na+] 12324
CC(=O)[O-].O.O.O.[Na+] 21711
CC(=O)[O-].O.O.O.[Na+] 42426
c1ccc(c(c1)N(CC(=O)O)CC(=O)O)OCCOc2ccccc2N(CC(=O)O)CC(=O)O 12331
C1CCN(C1)CCCC#N 12333
[NH4+].[Cl-] 12334
[NH4+].[Cl-] 19997
[NH4+].[Cl-] 42328
[NH4+].[Cl-] 39318
[NH4+].[Cl-] 39640
O.O.[Cl-].[Cl-].[Ca+2] 12335
O.O.[Cl-].[Cl-].[Ca+2] 20778
O.O.[Cl-].[Cl-].[Ca+2] 42352
C(=O)(O)[O-].[Na+] 12336
C(=O)(O)[O-].[Na+] 21712
C(=O)(O)[O-].[Na+] 42427
O.O.O.O.O.[O-]S(=O)(=O)[S-].[Na+].[Na+] 12337
O.O.O.O.O.[O-]S(=O)(=O)[S-].[Na+].[Na+] 20285
O.O.O.O.O.[O-]S(=O)(=O)[S-].[Na+].[Na+] 42446
c1cc(ccc1C(CCCCl)c2ccc(cc2)F)F 12339
COC(=O)C1=C(CCN(C1)Cc2ccccc2)[O-].O.[Na+] 12341
c1ccc(cc1)C(CN2CCSC2=N)O.Cl 12343
CCC(=O)c1ccc(cc1Cl)Cl 12344
CCC(=O)c1ccc(cc1Cl)Cl 29075
c1cc(ccc1CC(=O)Cl)Cl 12345
C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)OC[C@@H]2[C@H]([C@@H]([C@H]([C@@H](O2)Oc3cc(c4c(c3)O[C@@H](CC4=O)c5ccc(c(c5)O)OC)O)O)O)O)O)O)O 12346
c1[nH]ncn1 12347
c1[nH]ncn1 13928
COC(=O)c1ccc(cc1)S(=O)(=O)c2ccc(cc2)C(=O)OC 12349
CCCC(=O)C 12350
CCCC(=O)C 13000
c1ccc(cc1)[SeH] 12352
CCCC[N+](CCCC)(CCCC)CCCC.[OH-] 12353
CCCC[N+](CCCC)(CCCC)CCCC.[OH-] 17661
CCCC[N+](CCCC)(CCCC)CCCC.[OH-] 21291
CCCC[N+](CCCC)(CCCC)CCCC.[OH-] 42012
CCCC[N+](CCCC)(CCCC)CCCC.[OH-] 36632
CNc1ccc(cc1)[N+](=O)[O-] 12357
c1ccc(cc1)C(=O)c2cccc(c2)Cl 12358
C(=O)([O-])[O-].[Na+].[Na+] 12367
C(=O)([O-])[O-].[Na+].[Na+] 20680
C(=O)([O-])[O-].[Na+].[Na+] 20776
C(=O)([O-])[O-].[Na+].[Na+] 20781
C(=O)([O-])[O-].[Na+].[Na+] 42428
O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Al+3].[Al+3] 12368
O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.O.[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[O-]S(=O)(=O)[O-].[Al+3].[Al+3] 40059
CCOP(=O)(CC(=O)C)OCC 12369
c1cc2cccnc2c(c1)N 12371
Cc1nnc(s1)S 12374
C(C(C(F)(F)F)(F)F)(C(N(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F.C(C(C(F)(F)F)(F)F)(C(N(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)C(F)(F)F)(F)F)(F)F 12376
C(C(C(F)(F)F)(F)F)(C(N(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F 12377
C(C(C(N(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(C(C(F)(F)F)(F)F)(F)F 12378
C(C(C(C(F)(F)F)(F)F)(F)F)(C(C(F)(F)F)(F)F)(F)F 12379
C1(C(C(OC1(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)F)(F)F)(F)F)(F)F 12380
C[Si](C)(C)C#CC[P+](c1ccccc1)(c2ccccc2)c3ccccc3.[Br-] 12383
C[C@]1(c2cccc(c2C(=O)C3=C([C@]4([C@@H]([C@H]([C@@H]31)O)[C@@H](C(=C(C4=O)C(=O)N)O)N(C)C)O)O)O)O.O.O 12384
CC[N+](CC)(CC)Cc1ccccc1.[Cl-] 16402
c1ccc2c(c1)c(=O)cc(o2)C(=O)O 12388
C[Se][Se]C 12390
C[Se]C([Se]C)[Se]C 12391
CC([Se]C)[Se]C 12393
c1ccc2c(c1)c(=O)n(c(=O)[nH]2)CCCl 12396
CCCC[N+](CCCC)(CCCC)CCCC.Br[Br-]Br 12397
CCOCC 32686
CCOCC 36433
CCOCC 41005
CCOCC 61507
CCOCC 61508
CCOCC 12399
CCOCC 17682
CCOCC 17683
CCOCC 41006
c1cc(cc(c1)C(F)(F)F)C2(CCNCC2)O.Cl 12401
CC(=O)O 12404
CC(=O)O 14893
CC(=O)O 22214
CC(=O)O 29532
CC(=O)O 42322
CC(=O)O 61321
C1CNCCC1C(=O)O.Cl 12408
CCOC(=O)CN=C(c1ccccc1)c2ccccc2 12413
c1ccc(cc1)C(=NCC#N)c2ccccc2 12414
Cc1cc(c(cc1Br)F)Br 12415
c1cc(ccc1OCCBr)F 12416
COc1ccc(cc1C(=O)OC)Cl 12418
[OH-].[Na+] 12419
[OH-].[Na+] 12426
[OH-].[Na+] 13407
[OH-].[Na+] 20606
[OH-].[Na+] 25986
[OH-].[Na+] 34968
[OH-].[Na+] 35862
[OH-].[Na+] 42433
[OH-].[Na+] 37218
[OH-].[Na+] 38021
[OH-].[Na+] 38304
Cl 12420
Cl 12421
Cl 12462
Cl 12463
Cl 13370
Cl 42379
Cl 61322
Cl 61323
Cl 36652
Cl 36846
Cl 36847
Cl 38779
Cl 38780
Cl 38836
Cl 39174
Cl 38870
Cl 38930
Cl 38931
II 12422
II 19656
II 42382
II 38705
II 21249
OS(=O)(=O)O 12423
OS(=O)(=O)O 12424
OS(=O)(=O)O 12464
OS(=O)(=O)O 13361
OS(=O)(=O)O 30207
OS(=O)(=O)O 42452
[N+](=O)([O-])[O-].[Ag+] 12425
[N+](=O)([O-])[O-].[Ag+] 19768
[N+](=O)([O-])[O-].[Ag+] 41935
[N+](=O)([O-])[O-].[Ag+] 41936
[O-]S(=O)(=O)[S-].[Na+].[Na+] 12427
[O-]S(=O)(=O)[S-].[Na+].[Na+] 20287
C(=O)(C(=O)O)O 12428
C(=O)(C(=O)O)O 18643
C(=O)(C(=O)O)O 22082
CC(C)(Cc1ccccc1)O 12429
CC(C)(CCl)c1ccccc1 12434
CC(C)C(C(C)(C)CO)O 12435
CC(C)C(C(C)(C)CO)O 42199
CC(C)CC(CC(C)C)O 12436
c1cc2c(cc[nH]2)c(c1)[N+](=O)[O-] 12438
CC(CC(C)O)O 16846
Cc1ccc(cc1F)Br 12447
c1cc(ccc1C(=O)O)I 12448
c1ccc(cc1)COC(=O)Cl 12449
c1ccc(cc1)COC(=O)Cl 15294
CSC(=NC#N)SC 12451
c1cc(c[n+](c1)[C@H]2[C@@H]([C@@H]([C@H](O2)COP(=O)([O-])OP(=O)(O)OC[C@@H]3[C@H]([C@H]([C@@H](O3)n4cnc5c4ncnc5N)O)O)O)O)C(=O)N.O.O.O.O 12453
c1cc(c(cc1Cl)Cl)C(=O)CCl 12458
c1cc(c(cc1Cl)Cl)C(=O)CCl 17028
c1cc(c(cc1Cl)Cl)C(=O)CCl 29145
C[C@]12CCC(=O)C=C1CC[C@@H]3[C@@]2([C@H](C[C@]4([C@H]3CC[C@]4(C)O)C)O)F 12459
[N+](=O)(O)[O-] 12466
[N+](=O)(O)[O-] 13362
[N+](=O)(O)[O-] 42400
[N+](=O)(O)[O-] 61122
[N+](=O)(O)[O-] 61190
[N+](=O)(O)[O-] 61320
C(=O)([O-])[O-].[Ca+2] 12467
C(=O)([O-])[O-].[Ca+2] 21916
C(=O)([O-])[O-].[Ca+2] 40379
C(=O)([O-])[O-].[Ca+2] 40381
C(=O)([O-])[O-].[Ca+2] 42351
CCCCCCCCCCCCCCc1ccccc1 12468
CCCCCCCCCCCCCCCCc1ccccc1 12469
CCCCCCCCCCCCCCCCCCc1ccccc1 12470
CCCCCCCCOCCOCCO 12472
CCCCCCCCOCCOCCOCCOCCO 12474
C1C[C@H](C=C[C@@H]1O)O 12481
CC(=O)Nc1nccs1 12483
COCCOCCN(CCOCCOC)CCOCCOC 12485
O.O.O.O.O.O.O.[O-]S(=O)(=O)[O-].[Mg+2] 12490
O.O.O.O.O.O.O.[O-]S(=O)(=O)[O-].[Mg+2] 21311
O.O.O.O.O.O.O.[O-]S(=O)(=O)[O-].[Mg+2] 42390
C(C(=O)O)C(CC(=O)O)(C(=O)O)O.O 12491
c1ccc2c(c1)C(=O)N(C2=O)CCO 12492
c1cc(ccc1N2CCNCC2)[N+](=O)[O-] 12494
c1ccc(cc1)C(c2ccccc2)(C3CCNCC3)O.Cl 12498
O.O.O.O.O.O.[Cl-].[Cl-].[Cl-].[Fe+3] 12503
O.O.O.O.O.O.[Cl-].[Cl-].[Cl-].[Fe+3] 19669
O.O.O.O.O.O.[Cl-].[Cl-].[Cl-].[Fe+3] 21709
O.O.O.O.O.O.[Cl-].[Cl-].[Cl-].[Fe+3] 42370
C[C@@H](C(=O)O)O 12507
C[C@@H](C(=O)O)O 18987
C([C@@H]1[C@@H]([C@@H]([C@H]([C@@H](O1)O[C@@H]2[C@H](O[C@@H]([C@@H]([C@H]2O)O)O)CO)O)O)O)O.O 12509
C([C@@H]1[C@@H]([C@@H]([C@H]([C@@H](O1)O[C@@H]2[C@H](O[C@@H]([C@@H]([C@H]2O)O)O)CO)O)O)O)O.O 41297
C([C@@H]1[C@@H]([C@@H]([C@H]([C@@H](O1)O[C@@H]2[C@H](O[C@@H]([C@@H]([C@H]2O)O)O)CO)O)O)O)O.O 36889
CC(C)C[C@@H](C(=O)O)N 12512
CC(C)C[C@@H](C(=O)OC)N.Cl 12513
CC(=O)CCC(=O)O 12514
CC(=CCCC(C)(C=C)O)C 12515
[Li+].CC(C)(C)O[AlH-](OC(C)(C)C)OC(C)(C)C 12516
[Li+].CC(C)(C)O[AlH-](OC(C)(C)C)OC(C)(C)C 37758
c1cnc-2c(=O)[nH]c(=O)nc2[nH]1 12517
Cc1ccnc(c1)C 12518
Cc1cccc(n1)C 12519
Cc1cccc(n1)C 41335
Cc1ccncc1C 12520
Cc1cc(cnc1)C 12521
C(CCN)C[C@@H](C(=O)O)N.Cl 12522
C(=C\C(=O)O)\C(=O)O 12523
C(C(C(=O)O)O)C(=O)O 12525
C(C(C(=O)O)O)C(=O)O 21997
C(C(=O)O)C(=O)O 12526
C(C#N)C#N 12527
c1ccc(cc1)[C@@H](C(=O)O)O 12530
c1ccc(cc1)C(C(=O)O)O 12531
c1ccc(cc1)C(C(=O)O)O 22086
c1ccc(cc1)[C@H](C(=O)O)O 12532
CC1(Nc2cccc3c2c(ccc3N=Nc4ccc(c5c4cccc5)N=Nc6ccccc6)N1)C 41983
CC1(Nc2cccc3c2c(ccc3N=Nc4ccc(c5c4cccc5)N=Nc6ccccc6)N1)C 19016
c1(nc(nc(n1)N)N)N 12535
c1(nc(nc(n1)N)N)N 22048
CC(=O)NCCc1c[nH]c2c1cc(cc2)OC 12536
C[C@@H]1CC[C@H]([C@@H](C1)O)C(C)C 12539
C[C@@H]1CC[C@H]([C@@H](C1)O)C(C)C 12540
CC1CCC(C(=O)C1)C(C)C 12541
C(C(=O)O)S 12543
c1ccc2c(c1)[nH]c(n2)S 12544
c1ccc2c(c1)nc(s2)S 12545
c1ccc2c(c1)nc(s2)S 33205
c1ccc2c(c1)nc(o2)S 12546
C(CS)O 12547
Cn1ccnc1S 12550
Cc1ccnc(n1)S.Cl 12551
C(C(CS)O)O 12552
C(CS)C(=O)O 12553
c1ccnc(c1)S 12554
C(C(C(=O)O)S)C(=O)O 12555
C1CSC(=N1)S 12556
Cc1cc(c(c(c1)C)C=O)C 12557
Cc1cc(cc(c1)C)C 12558
Cc1cc(cc(c1)C)C 16132
Cc1cc(c(c(c1)C)S(=O)(=O)Cl)C 12559
CC(=CC(=O)C)C 12560
CC(=CC(=O)C)C 41370
CS(=O)(=O)O 12561
CS(=O)(=O)O 12562
CS(=O)(=O)Cl 12564
CSCCC(C(=O)O)N 12565
CC(=O)c1ccccc1OC 12567
CC(=O)c1cccc(c1)OC 12568
COCC(=O)Cl 12570
COc1ccc(cc1)C(=O)N 12572
COc1ccc(cc1)S(=O)(=O)Cl 12573
COc1ccc(cc1)C(=O)c2ccccc2 12574
COc1ccc(cc1)C(=O)CCC(=O)O 12575
COc1ccccc1CO 12576
COc1cccc(c1)CO 12577
COc1ccc(cc1)CN 12578
CC(CCO)OC 12579
COc1cccc(c1O)O 12581
COc1ccccc1/C=C/C(=O)O 12582
COc1cccc(c1)/C=C/C(=O)O 12583
COc1ccc(cc1)/C=C/C(=O)O 12584
COCCOCCOC 12585
CN(C)Cc1c[nH]c2c1cc(cc2)OC 12586
COc1ccc2c(c1)cc[nH]2 12587
COc1ccc2c(c1)c(c[nH]2)CC(=O)O 12588
COc1ccc2c(c1)c(c[nH]2)C=O 12589
COc1ccc2c(c1)cc([nH]2)C(=O)O 12590
Cc1cc(ccc1N)OC 12591
Cc1nc2cc(ccc2[se]1)OC 12593
Cc1cc2cc(ccc2[nH]1)OC 12594
COc1ccc(c(c1)[N+](=O)[O-])N 12596
COc1cccc(c1[N+](=O)[O-])C(=O)O 12597
COc1ccc(c2c1cccc2)[N+](=O)[O-] 12598
COc1ccc(cn1)[N+](=O)[O-] 12599
COc1ccc(cc1)O 12600
COc1cccc(c1)CC(=O)O 12601
COc1ccc(cc1)CC(=O)O 12602
COc1ccccc1N2CCNCC2 12604
COc1ccc(cc1)N2CCNCC2.Cl.Cl 12606
COc1ccccc1CCC(=O)O 12607
COc1ccc(cc1)CCC(=O)O 12608
CCC(=O)c1ccc(cc1)OC 12609
COc1ccccn1 12610
COc1cc[n+](cc1)[O-] 12611
COc1ccc2c(c1)CCCC2=O 12612
COc1ccc2c(c1)c(c[nH]2)CCN.Cl 12613
CC(=O)NC 12614
CC(=O)CC(=O)OC 12615
Cc1ccccc1C(=O)C 12616
Cc1ccc(cc1)C(=O)C 12618
COC(=O)C=C 12619
C[C@H](CCC(=O)O)CC(=O)O 12620
CC(CCC(=O)O)CC(=O)O 12621
CNCCC#N 12622
CN 12623
CN 36849
CN 36855
CNCC(OC)OC 12624
CNc1ccccc1 12627
CNc1ccccc1 21693
Cc1ccccc1OC 12628
Cc1c2ccccc2cc3c1cccc3 12630
COC(=O)c1ccccc1N 12632
Cc1[nH]c2ccccc2n1 12633
COC(=O)c1ccccc1 12634
Cc1ccc(cc1)C(=O)c2ccccc2 12635
Cn1c2ccccc2sc1=S 12636
COC(=O)C(=O)c1ccccc1 12637
Cc1nc2ccccc2[se]1 12638
CC(c1ccccc1)N 12639
Cc1ccc(cc1)CN 12640
CC(C#N)c1ccccc1 12641
Cc1ccccc1CC#N 12642
Cc1cccc(c1)CC#N 12643
Cc1ccc(cc1)CC#N 12644
COC(=O)/C=C/CBr 12645
COC(=O)CCCCBr 12646
CCC(C)C 12647
CCC(C)C 16784
CC(C)CCO 12648
CC(C)CCO 41273
CC=C(C)C 12649
CC=C(C)C 41409
Cc1ccc(c(c1)O)O 12651
Cc1ccc(c(c1)O)O 34869
COC(=O)CCCCl 12652
COC(=O)Cl 12653
COC(=O)CCCC(=O)Cl 12654
C/C(=C\c1ccccc1)/C(=O)O 12655
Cc1ccc(cc1)/C=C/C(=O)O 12656
Cc1ccc2c(c1)ccc(=O)o2 12657
CC1CCCCC1 12658
CC1C(=O)CCCC1=O 12659
CC1(CCCCC1)O 12660
CC1CCCCC1=O 12661
CC1CCCC(=O)C1 12663
CC1=CC(=O)CCC1 12666
CC1(CCCC1)O 12668
CC1=CCCC1 12670
COC(=O)C1CC1 12671
CN(CCO)CCO 12672
COC(=O)c1ccc(cc1O)O 12673
CN(C)c1ccc(cc1)Cc2ccc(cc2)N(C)C 12674
CN(C)c1ccc2c(c1)[s+]c3cc(ccc3n2)N(C)C.O.O.O.[Cl-] 12675
C1CN2CCC1C(C2CO)(O)O.O.O.Cl 12678
CN(C=O)c1ccccc1 12681
COC=O 12682
COC=O 41434
Cc1ccco1 12683
CNCC(C(C(C(CO)O)O)O)O 12684
CC(CC(=O)O)CC(=O)O 12686
CC1CC(=O)OC(=O)C1 12687
CCCCCC(C)C 12688
CCCC(C)C(CC)O 12689
CCCCC(C)C 12691
CCCC(C)CC 12692
CCCC(C(C)C)O 12693
CN1CC(=O)NC1=O 12694
CNN 12695
COC(=O)c1ccc(cc1)O 12696
CC(C)(C(=O)OC)O 12697
CNO.Cl 12698
Cn1ccnc1 12699
Cc1[nH]ccn1 12700
CN(CC(=O)O)CC(=O)O 12701
Cc1cc2ccccc2[nH]1 12702
Cc1c[nH]c2c1cccc2 12703
Cc1cccc2c1[nH]cc2 12704
COC(=O)c1ccncc1 12706
CN1C(=O)C=CC1=O 12708
CC(C(=O)O)C(=O)O 12709
COC(=O)C(c1ccccc1)O 12710
CC(=C)C(=O)OC 12714
CN1CCOCC1 12715
Cc1cccc2c1cccc2 12716
Cc1ccc2ccccc2c1 12717
CC1=CC(=O)c2ccccc2C1=O 12718
Cc1nc2c3ccccc3ccc2s1 12719
CNC(=O)c1cccnc1 12720
COC(=O)c1cccnc1 12721
Cc1cccc(c1N)[N+](=O)[O-] 12723
Cc1ccc(c(c1)[N+](=O)[O-])N 12724
Cc1ccc(cc1[N+](=O)[O-])N 12725
Cc1cccc(c1[N+](=O)[O-])OC 12726
Cc1cccc(c1[N+](=O)[O-])C(=O)O 12727
Cc1cc(ccc1[N+](=O)[O-])C(=O)O 12728
Cc1ccc2ccccc2c1[N+](=O)[O-] 12729
Cc1cc(ccc1[N+](=O)[O-])O 12730
Cc1ccc(c(c1)[N+](=O)[O-])O 12731
CC12CCC(=O)C=C1CCCC2=O 12733
CCCC(C)C 12734
CCC(C)CC 12735
CC(C)CCCO 12737
CC(C)CC(=O)C 12739
CC(C)CC(=O)C 22217
CC(C)CC(=O)C 25566
CC(C)CC(=O)C 32792
CC(C)CC(=O)C 42396
CCCC(=C)C 12740
CC(C)CC=C 12742
CNCCc1ccccc1 12745
CC1=NN(C(=O)C1)c2ccccc2 12746
CC1CNCCN1 12747
CN1CCCCC1 12748
CC1CCCCN1 12749
CC1CCCNC1 12750
CC1CCNCC1 12751
CN(CC#C)Cc1ccccc1 12753
CCCC(C)(CO)CO 12754
Cc1cnccn1 12755
Cc1cc[nH]n1 12756
Cc1cccc(n1)C=O 12757
Cn1ccccc1=O 12758
Cn1cccc1 12760
CN1CCCC1 12761
CN1CCCC1=O 12763
CN1CCCC1=O 22208
CN1CCCC1=O 32693
CN1CCCC1=O 35489
CN1CCCC1=O 35490
CN1CCCC1=O 36438
CN1CCCC1=O 61041
CN1CCCC1=O 36845
CN1CCCC1=O 39068
CC(=O)C(=O)OC 12765
Cc1cnc2ccccc2n1 12766
Cc1c(cccc1O)O 12767
Cc1c(cccc1O)O 36474
COC(=O)c1ccccc1O 12768
COC(=O)c1ccccc1O 22049
Cc1ccc(cc1)C=C 12770
CC(=C)c1ccccc1 12771
C/C=C/c1ccccc1 15015
COC(=O)CCC(=O)O 12773
CSC 12776
CS(=O)(=O)C 12778
CS(=O)C 12779
CS(=O)C 16785
CS(=O)C 29552
CS(=O)C 32688
CS(=O)C 32718
CS(=O)C 34844
CS(=O)C 35484
CS(=O)C 41488
CS(=O)C 61042
CS(=O)C 61097
CS(=O)C 39075
CC1c2ccccc2CCC1=O 12782
CC1CCC(=O)c2c1cccc2 12783
CC1=NCCS1 12784
Cc1cccs1 12785
Cc1ccsc1 12786
Cc1ccc(s1)C=O 12787
Cc1ccc(s1)C(=O)O 12788
CSC(=N)N.CSC(=N)N.OS(=O)(=O)O 12789
CNC(=S)N 12790
Cc1ccc(cc1)S(=O)(=O)C 12791
C[Si](Cl)(Cl)Cl 12793
COc1cc(cc(c1OC)OC)C(=O)OC 12794
CC(C)(C)C(=O)OC 12795
CC(Cc1c[nH]c2c1cccc2)N 12796
Cc1ccc2c(c1)c(c[nH]2)CC(C(=O)O)N 12797
CNC(=O)N 12799
CC(=O)C=C 12800
c1cn(cc(c1=O)O)C[C@@H](C(=O)O)N 12801
C(C(C(C(=O)O)O)O)(C(C(=O)O)O)O 12804
C(=O)/C(=C(/C(=O)O)\Br)/Br 12805
C(=O)/C(=C(/C(=O)O)\Cl)/Cl 12806
C(=C/C(=O)O)\C=C\C(=O)O 12807
CC(=CCCC(=C)C=C)C 12808
c1ccc2c(c1)cccc2C=O 12809
c1ccc2cc(ccc2c1)C=O 12810
c1ccc2cc(c(cc2c1)C(=O)O)C(=O)O 12811
c1cc2cccc3c2c(c1)C(=O)OC3=O 12814
c1cc2cccc3c2c(c1)C(=O)NC3=O 12815
c1ccc(cc1)c2cc(=O)c3ccc4ccccc4c3o2 12816
c1ccc(cc1)c2cc(=O)c3c4ccccc4ccc3o2 12817
c1ccc2c(c1)cccc2C(=O)O 12818
c1ccc2c(c1)cccc2O 12819
c1ccc2c(c1)cccc2O 41530
c1ccc2cc(ccc2c1)OCC(=O)O 12820
c1ccc2cc(ccc2c1)CC(=O)O 12822
c1ccc2c(c1)cccc2CC#N 12823
c1ccc2c(c1)cccc2N=C=S 12824
CC(C)(C)CO 12825
CC1=O[Ni+2]2(O=C([CH-]1)C)O=C([CH-]C(=O2)C)C 12826
c1cc(cnc1)C(=O)N 12827
c1cc(cnc1)C(=O)N 22000
c1cc(c[n+](c1)[O-])C(=O)N 12828
c1cc(cnc1)C(=O)O 12829
c1cc(cnc1)C(=O)O 38032
C1CC(CNC1)C(=O)N 12830
CC(=O)c1ccccc1[N+](=O)[O-] 12832
CC(=O)c1cccc(c1)[N+](=O)[O-] 12833
CC(=O)c1ccc(cc1)[N+](=O)[O-] 12834
c1ccc(c(c1)N)[N+](=O)[O-] 12835
c1cc(cc(c1)[N+](=O)[O-])N 12836
c1cc(ccc1N)[N+](=O)[O-] 12837
c1cc(ccc1N)[N+](=O)[O-] 18069
C(C[C@@H](C(=O)O)N)CNC(=N)NN(=O)=O 12839
c1ccc(c(c1)C=O)[N+](=O)[O-] 12840
c1cc(cc(c1)[N+](=O)[O-])C=O 12841
c1ccc(cc1)[N+](=O)[O-] 12842
c1ccc(cc1)[N+](=O)[O-] 41578
c1cc2c(cc1[N+](=O)[O-])nc[nH]2 12844
c1cc(cc(c1)[N+](=O)[O-])C(=O)O 12845
c1cc(cc(c1)[N+](=O)[O-])C(=O)O 18070
c1cc(ccc1C(=O)O)[N+](=O)[O-] 12846
c1cc(ccc1C#N)[N+](=O)[O-] 12848
c1ccc(cc1)C(=O)c2ccc(cc2)[N+](=O)[O-] 12849
c1cc2c(c(c1)[N+](=O)[O-])nsn2 12850
c1ccc(c(c1)CO)[N+](=O)[O-] 12851
c1cc(ccc1CO)[N+](=O)[O-] 12852
c1cc(ccc1CBr)[N+](=O)[O-] 12853
c1cc(ccc1Cc2ccncc2)[N+](=O)[O-] 12855
c1ccc(cc1)c2ccccc2[N+](=O)[O-] 12856
c1ccc(cc1)c2cccc(c2)[N+](=O)[O-] 12857
C(CS(=O)(=O)O)NC(CO)(CO)CO 20751
c1cc(c(cc1[N+](=O)[O-])O)O 12860
c1ccc(c(c1)/C=C/C=O)[N+](=O)[O-] 12861
c1ccc(c(c1)/C=C/C(=O)O)[N+](=O)[O-] 12862
c1cc(ccc1/C=C/C(=O)O)[N+](=O)[O-] 12863
c1ccc-2c(c1)Cc3c2ccc(c3)[N+](=O)[O-] 12865
C(=N)(N)NN(=O)=O 12867
c1cc2cn[nH]c2cc1[N+](=O)[O-] 12869
c1cc2c(cc[nH]2)cc1[N+](=O)[O-] 12870
c1cc2c(cc1[N+](=O)[O-])NCC2 12871
c1c(cc(cc1C(=O)O)[N+](=O)[O-])C(=O)O 12873
c1ccc(c(c1)[N+](=O)[O-])O 12874
CC(=O)Oc1ccc(cc1)[N+](=O)[O-] 12875
c1cc(ccc1CC(=O)O)[N+](=O)[O-] 12876
c1cc(c(cc1N)[N+](=O)[O-])N 12880
c1ccc(c(c1)[N+](=O)[O-])O[C@H]2[C@@H]([C@H]([C@H]([C@H](O2)CO)O)O)O 12882
c1ccc(c(c1)NN)[N+](=O)[O-] 12883
c1cc(cc(c1)[N+](=O)[O-])NN.Cl 12884
c1ccc(cc1)Oc2ccc(cc2)[N+](=O)[O-] 12885
c1cc(ccc1[N+](=O)[O-])OP(=O)([O-])[O-].O.O.O.O.O.O.[Na+].[Na+] 12886
CCC[N+](=O)[O-] 12890
c1c[n+](ccc1[N+](=O)[O-])[O-] 12892
c1cc2c(cccn2)c(c1)[N+](=O)[O-] 12893
C=Cc1cccc(c1)[N+](=O)[O-] 12899
c1cc(c(cc1C(=O)O)[N+](=O)[O-])C(=O)O 12900
c1cc(sc1)[N+](=O)[O-] 12901
Cc1ccccc1[N+](=O)[O-] 12903
Cc1cccc(c1)[N+](=O)[O-] 12904
Cc1ccc(cc1)[N+](=O)[O-] 12905
COc1cc(cc(c1O)[N+](=O)[O-])C=O 12906
COc1cc(c(cc1OC)[N+](=O)[O-])C=O 12907
Cc1cccc(c1[N+](=O)[O-])C 12908
Cc1ccc(cc1C)[N+](=O)[O-] 12909
CCCCCCCCCCCCCCCCCCC 12910
CCCCCCCCC 12911
C(CCCCO)CCCCO 12912
C(CCCCS)CCCCS 12913
CCCCCCCCC(=O)O 12914
CCCCCCCCC(=O)O 35624
CCCCCCCC(C)O 12915
CCCCCCCCCN 12918
C1CC2CC1C=C2 12924
C1CC2CC1CC2=O 12925
c1ccc2c(c1)c3ccncc3[nH]2 12926
CCCCCCCCCCCCCCCCCCCCCCCCCCCC 12927
CCCCCCCCCCCCCCCCCC(=O)N 12928
CCCCCCCCCCCCCCCCCC 12929
CCCCCCCCCCCCCCCCCCO 12930
CCCCCCCCCCCCCCCCC=C 12931
CCCCCCCCCCCCCCCCCCN 12932
C=CCCCCC=C 12935
c1(c(c(c(c(c1F)F)F)F)F)C(F)(F)F 12936
CCCCCCCC 12937
CCCCCCCC 32595
CCCCCCCC(=O)O 12939
CCCCCCCC(=O)O 16726
CCCCC1CCC(=O)O1 12940
CCCCCCC(C)O 12941
CCCCCCC(=O)C 12942
CCCCCCCC(=O)Cl 12943
CCCCCCC=C 12944
CCCCCCC=C 30125
CCCCC/C=C/C(=O)O 12946
CCCCC[C@@H](C=C)O 12947
CCCCCCCC=O 12948
CCCCCCCCN 12949
CC(C)(C)CC(C)(C)N 12950
CC(C)(C)CC(C)(C)N=C=S 12951
CCCCCCCC/C=C\CCCCCCCCO 12953
CCCCCCCC/C=C\CCCCCCCCN 12954
Cc1cc(cc(c1)O)O.O 12955
C(C[C@@H](C(=O)O)N)CN.Cl 12956
c1c([nH]c(=O)[nH]c1=O)C(=O)O.O 12957
C1CC2CCC1O2 12959
C(=O)(C(=O)O)O.O.O 12960
C(=O)(C(=O)O)O.O.O 42315
C(=O)(C(=O)Cl)Cl 12961
C(=O)(C(=O)Cl)Cl 36918
C(=O)(C(=O)O)N 12962
C(=O)(C(=O)[O-])N.[Na+] 12963
C(=O)(C(=O)NN)N 12964
C(=O)(C(=O)N)N 12965
C1COC(=O)N1 12966
c1ccc2c(c1)CC(=O)N2 12967
CCCCCCCCCCCCCCCC(=O)O 12970
CCCCCCCCCCCCCCCC(=O)O 41669
c1ccc2c(c1)cc(c(c2Cc3c4ccccc4cc(c3O)C(=O)O)O)C(=O)O 12972
c1cc2ccc1CCc3ccc(cc3)CC2 12973
c1cc2ccc1CCc3ccc(cc3)CC2 29160
CC(C)([C@H](C(=O)O)N)S 12974
CC(C)(C(C(=O)O)N)S 12975
c1(c(c(c(c(c1Br)Br)Br)Br)Br)O 12978
c1ccc2cc3cc4cc5ccccc5cc4cc3cc2c1 12979
CCCCCCCCCCCCCCC 12982
CCCCCCCCCCCCCCC(=O)O 12983
CCCCCCCCCCCCCCCO 12984
CCCCCCCCCCCCCCCc1cccc(c1)O 12985
C=CCC=C 12986
C(C(CO)(CO)CO)O 12987
C(C(CCl)(CCl)CCl)Cl 12989
c1c(c(c(c(c1F)F)F)F)F 12990
c1(c(c(c(c(c1F)F)F)F)F)C(=O)O 12991
c1(c(c(c(c(c1F)F)S)F)F)F 12992
C(CCO)CCO 12995
CC(=O)CC(=O)C 12996
CCCCCS 12997
CCCC(C)O 12998
CCCC(C)O 41700
CCC(CC)O 12999
CCC(C=C)O 13001
CC(CC=C)O 38743
C(SCl)(Cl)(Cl)Cl 13003
C12(C(C(C(C(C1(F)F)(F)F)(F)F)(F)F)(C(C(C(C2(F)F)(F)F)(F)F)(F)F)F)F 13004
C1(C(C(C(C(C1(F)F)(F)F)(F)F)(F)F)(F)F)(C(F)(F)F)F 13005
C1(C(C(C(C(C1(F)F)(F)F)(F)F)(F)F)(F)F)(C(F)(F)F)F 32543
c1cc2cccc3c2c(c1)C=CC3=O 13006
c1cc2cccc3c2c(c1)c4cccc5c4c3ccc5 13007
c1cc2c3c(ccc4c3c1c5ccc6c7c5c4ccc7C(=O)OC6=O)C(=O)OC2=O 13008
c1ccc2c(c1)ccc3c2cccc3 13009
c1ccc2c(c1)ccc3c2cccc3 13010
c1ccc2c(c1)ccc3c2cccc3 41710
c1ccc2c(c1)-c3ccccc3C(=O)C2=O 16879
c1ccc2c(c1)-c3ccccc3C(=O)C2=O 41711
c1cc2ccc3cccnc3c2nc1.O 13013
c1cc2ccc3cccnc3c2nc1.O 41712
c1cc2ccc3cccnc3c2nc1.O.Cl 13014
c1ccc2c(c1)nc3ccccc3n2 13015
C[n+]1c2ccccc2nc3c1cccc3.COS(=O)(=O)[O-] 13016
c1ccc(cc1)CCO 13018
CCOc1ccc(cc1)N 13020
CCOc1ccc(cc1)N 41716
c1ccc2c(c1)Nc3ccccc3S2 13021
c1ccc2c(c1)Nc3ccccc3O2 13022
c1ccc(cc1)Oc2ccc(cc2)N 13023
c1ccc(cc1)OCCO 13024
c1ccc(cc1)OCCO 41729
c1ccc(cc1)OCCC(=O)O 13025
c1ccc(cc1)OCCCBr 13026
COC(Cc1ccccc1)OC 13027
c1ccc(cc1)CC(=O)O 13028
c1ccc(cc1)CC(=O)NN 13029
c1ccc(cc1)CC(=O)Cl 13030
c1ccc(cc1)C[C@@H](C(=O)O)N 13031
COC(=O)[C@H](Cc1ccccc1)N.Cl 13032
c1ccc(cc1)c2c3ccccc3cc4c2cccc4 13033
c1ccc(cc1)c2[nH]c3ccccc3n2 13035
c1ccc(cc1)c2[nH]c3ccccc3n2 18144
B(c1ccccc1)(O)O 13036
CCC(c1ccccc1)C(=O)O 13037
c1ccc(cc1)CCCC(=O)O 13038
c1ccc(cc1)OC(=O)N 13039
c1ccc(cc1)/C=C(\c2ccccc2)/C(=O)O 13042
c1ccc(cc1)C2(CCCCC2)O 13043
c1ccc(cc1)C2CCCCC2=O 13044
c1ccc(cc1)C2=CCCCC2 13045
c1ccc(cc1)[C@@H]2C[C@H]2C(=O)O 13046
c1ccc(cc1)OP(=O)(Cl)Cl 13048
c1ccc(cc1)N(CCO)CCO 13049
c1cc(cc(c1)CC(=O)O)CC(=O)O 13050
c1cc(ccc1CC(=O)O)CC(=O)O 13051
c1ccc(c(c1)CC#N)CC#N 13052
c1ccc(c(c1)N)N 13055
c1ccc(c(c1)N)N 32798
c1ccc(c(c1)N)N 32802
c1cc(cc(c1)N)N 13056
c1cc(ccc1N)N 13057
c1cc(ccc1N2C(=O)C=CC2=O)N3C(=O)C=CC3=O 13058
c1ccc(cc1)C(CO)O 13059
c1ccc(cc1)Oc2ccccc2 13060
c1ccc(cc1)Oc2ccccc2 22050
c1ccc(cc1)NCCN 13061
c1ccc(cc1)C2CCC(=O)OC2=O 13062
c1ccc(cc1)[C@H](C(=O)O)N 13063
c1ccc(cc1)C(C(=O)O)N 13064
c1ccc(cc1)C(C#N)N.Cl 13065
CCCCCCc1ccccc1 13066
c1ccc(cc1)c2cc3ccccc3[nH]2 13068
c1ccc(cc1)N=C=O 13069
c1ccc(cc1)C2=NOC(=O)C2 13070
c1ccc(cc1)N2C(=O)C=CC2=O 13071
CC(=O)O[Hg]c1ccccc1 13072
CC(=O)O[Hg]c1ccccc1 41763
c1ccc(cc1)[Hg]Cl 13073
c1ccc(cc1)c2cccc3c2cccc3 13075
c1ccc(cc1)c2ccccc2O 13076
c1ccc(cc1)Nc2ccccc2N 13077
c1ccc(cc1)P(=O)O 13078
c1ccc(cc1)P(=O)O 41770
c1ccc(cc1)P(=O)(O)O 13079
c1ccc(cc1)P(=O)(Cl)Cl 13080
c1ccc(cc1)N2CCNCC2 13082
CC(C)(c1ccccc1)O 13083
CC(C)(c1ccccc1)O 38077
c1ccc(cc1)C#CC(=O)O 13085
CC(c1ccccc1)C(=O)O 13087
c1ccc(cc1)CCCN 13088
c1ccc(cc1)c2ccncc2 13091
c1ccc(cc1)c2ccncn2 13092
c1ccc(cc1)C(CC(=O)O)C(=O)O 13094
c1ccc(cc1)Sc2ccccc2 13095
c1ccc(cc1)S(=O)(=O)c2ccccc2 13096
c1ccc(cc1)S(=O)c2ccccc2 13097
Cc1ccc(cc1)c2ccccc2 13098
c1ccc(cc1)[Si](Cl)(Cl)Cl 13100
c1ccc(cc1)c2c3cc(c(cc3oc-4cc(=O)c(cc24)O)O)O 13101
c1ccc(cc1)NC(=O)N 13102
c1ccc(cc1)CCCCC(=O)O 13103
c1c(cc(cc1O)O)O.O.O 13104
c1ccc2cnncc2c1 13105
c1ccc2c(c1)c(=O)[nH][nH]c2=O 13106
c1ccc(c(c1)C(=O)O)C(=O)O 13107
c1ccc(c(c1)C=O)C=O 13108
c1ccc2c(c1)COC2=O 13109
c1ccc2c(c1)C(=O)NC2=O 13110
c1ccc(c(c1)C(=O)Cl)C(=O)Cl 13111
Cc1cccnc1 13113
Cc1cccc[n+]1[O-] 13114
Cc1ccc[n+](c1)[O-] 13115
Cc1cc[n+](cc1)[O-] 13116
c1ccnc(c1)C(=O)O 13117
c1cc[n+](c(c1)C(=O)O)[O-] 13118
c1cc(cnc1)CCl.Cl 13119
c1cnccc1CCl.Cl 13120
CC(=C)[C@@H]1[C@@H]2[C@@H]3[C@@]4([C@]([C@H]1C(=O)O2)(C[C@@H]5[C@]4(O5)C(=O)O3)O)C.C[C@@]12[C@H]3[C@H]4[C@H]([C@@H]([C@@]1(C[C@@H]5[C@]2(O5)C(=O)O3)O)C(=O)O4)C(C)(C)O 13121
C(CCC(=O)O)CCC(=O)O 13123
CC(=O)C(C)(C)C 13125
CC1=CCC2CC1C2(C)C 13126
CC1=CCC2CC1C2(C)C 13127
C1CCNC(C1)C(=O)O 13128
C1CNCCN1 13129
C1CNCCN1.O.O.O.O.O.O 13130
C1CCNCC1.Cl 13131
c1cc2c(cc1/C=C/C=C/C(=O)N3CCCCC3)OCO2 38145
c1cc2c(cc1C=O)OCO2 13134
c1cc2c(cc1CO)OCO2 13135
c1cc2c(cc1CN)OCO2 13136
c1cc2c(cc1C(=O)O)OCO2 13137
CC(=O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC=C4[C@@]3(CC[C@@H](C4)OC(=O)C)C)C 13139
C(CO)CO 13140
C(CS)CS 13141
CCCS 13143
CC(C)S 13144
C#CCO 13145
C#CCN 13146
C#CCN.Cl 13147
C#CCBr 13148
C#CCON1C(=O)c2ccccc2C1=O 13149
C#CC(=O)O 13150
CCC=O 13151
CCC=O 22051
CCC(=O)OC(=O)CC 13152
CCC(=O)Cl 13153
CCC(=O)c1ccccc1 13154
CC1COC(=O)O1 13156
CCCOC(=O)c1cc(c(c(c1)O)O)O 13158
CCCOC(=O)c1ccc(cc1)O 13159
CCCN=C=O 13160
CCCc1ccccc1O 13161
CCCc1ccc(cc1)O 13162
CCCS(=O)CCC 13164
C1C(=O)NC(=N)S1 13165
c1c2c([nH]cn2)ncn1 13167
c1cnccn1 13170
c1cnc(cn1)C(=O)O 13171
c1cnc(c(n1)C(=O)N)C(=O)N 13172
c1c[nH]nc1 13174
c1c([nH]nc1C(=O)O)C(=O)O.O 13175
c1ccnnc1 13176
c1ccncc1 13178
c1ccncc1 18022
c1ccncc1 33942
c1ccncc1 36442
c1ccncc1 41853
c1ccncc1 41854
c1ccncc1 61044
c1ccncc1 61099
c1ccncc1 38656
c1ccncc1 29086
c1cc(cnc1)/C=N/O 13180
c1ccnc(c1)C=O 13182
c1cc(cnc1)C=O 13183
c1cnccc1C=O 13184
c1cc(c(nc1)C(=O)O)C(=O)O 13185
c1cnc(cc1C(=O)O)C(=O)O 13186
c1cc(ncc1C(=O)O)C(=O)O 13187
c1cc(nc(c1)C(=O)O)C(=O)O 13188
c1cncc(c1C(=O)O)C(=O)O 13189
c1c(cncc1C(=O)O)C(=O)O 13190
c1cc2c(nc1)C(=O)OC2=O 13191
c1cc(cnc1)S(=O)(=O)O 13192
c1ccnc(c1)CC(=O)O.Cl 13195
c1cc(cnc1)CC(=O)O.Cl 13196
c1ccnc(c1)CO 13199
c1cc(cnc1)CO 13200
c1c[n+](ccc1CO)[O-] 13201
c1cc[n+](cc1)c2ccncc2.Cl.[Cl-] 13204
c1cc([nH]c1)C=O 13206
C1CCNC1 13208
C1CC(=O)NC1 13211
C1CC(=O)NC1 22011
C1CC(=O)N[C@@H]1C(=O)O 13212
CC(=O)C(=O)O 13214
CC(=O)C(=O)[O-].[Na+] 13215
c1ccc(cc1)c2ccc(cc2)c3ccc(cc3)c4ccccc4 13216
c1ccc(cc1)c2ccc(cc2)c3ccc(cc3)c4ccccc4 41871
c1ccc(cc1)c2ccc(cc2)c3ccc(cc3)c4ccccc4 41872
Cc1ccc2ccccc2n1 13217
c1ccc2c(c1)C(=O)c3c(ccc(c3C2=O)O)O 13218
c1ccc2c(c1)cccn2 13219
c1ccc2c(c1)cccn2 22114
c1ccc2c(c1)c(cc(n2)O)O 13220
c1ccc2c(c1)nccn2 13222
C1CN2CCC1C(C2)O 13224
C1CN2CCC1C(C2)O.Cl 13225
C1CN2CCC1C(=O)C2.Cl 13226
c1cc(cc(c1)O)O 13229
CCN(CC)c1ccc2c(c1)oc-3cc(=[N+](CC)CC)ccc3c2c4ccccc4C(=O)O.[Cl-] 13231
CCN(CC)c1ccc2c(c1)oc-3cc(=[N+](CC)CC)ccc3c2c4ccccc4C(=O)O.[Cl-] 29657
CCN(CC)c1ccc2c(c1)oc-3cc(=[N+](CC)CC)ccc3c2c4ccccc4C(=O)O.[Cl-] 32704
CCN(CC)c1ccc2c(c1)oc-3cc(=[N+](CC)CC)ccc3c2c4ccccc4C(=O)O.[Cl-] 41900
C1C(=O)N(C(=S)S1)CC(=O)O 13232
c1(c(c(=O)c(=O)c(=O)c1=O)[O-])[O-].[Na+].[Na+] 13234
Cc1cc2c(cc1C)n(c-3nc(=O)[nH]c(=O)c3n2)C[C@@H]([C@@H]([C@@H](CO)O)O)O 13235
C([C@@H]1[C@H]([C@H](C(O1)O)O)O)O 13236
CC(=C)[C@H]1Cc2c(ccc3c2O[C@@H]4COc5cc(c(cc5[C@@H]4C3=O)OC)OC)O1 38430
c1ccc(cc1)c2c3ccccc3c(c4c2c(c5ccccc5c4c6ccccc6)c7ccccc7)c8ccccc8 13238
C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)OC[C@@H]2[C@H]([C@@H]([C@H]([C@@H](O2)Oc3c(=O)c4c(cc(cc4oc3c5ccc(c(c5)O)O)O)O)O)O)O)O)O)O.O.O.O 13239
C=CCc1ccc2c(c1)OCO2 13258
c1ccc(c(c1)CO)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O 13259
c1ccc(c(c1)C=O)O 13260
c1ccc(c(c1)C(=O)NN)O 13261
c1ccc(c(c1)C(=O)NO)O 13262
C(CCCCC(=O)O)CCCC(=O)O 13263
C(=O)(N)NN.Cl 13264
C(=O)(N)NN.Cl 26461
C(C(C(=O)O)N)O 13265
C([C@@H](C(=O)O)N)O 13266
COC(=O)[C@H](CO)N.Cl 13267
CN1CC(=O)N=C1N.c1cc2c(cc1O)c(c[nH]2)CCN.O.OS(=O)(=O)O 13268
c1cc2c(cc1O)OCO2 13269
C1[C@H]([C@@H]([C@@H](C=C1C(=O)O)O)O)O 13270
CC[C@H](CC[C@@H](C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC=C4[C@@]3(CC[C@@H](C4)O)C)C)C(C)C 13272
C(C(C(C(C(CO)O)O)O)O)O 13273
C(C(C(C(C(CO)O)O)O)O)O 22052
C(CCNCCCN)CN 13274
C(CCNCCCN)CNCCCN 13275
CC[C@H](/C=C/[C@@H](C)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC=C4[C@@]3(CC[C@@H](C4)O)C)C)C(C)C 13276
c1ccc(cc1)[C@H]2[C@@H](O2)c3ccccc3 13278
C=Cc1ccccc1 13279
C=Cc1ccccc1 22053
c1ccc(cc1)C2CO2 13280
C(CCCC(=O)O)CCC(=O)O 13281
C(CC(=O)Cl)C(=O)Cl 13284
c1cc(ccc1N)S(=O)(=O)N 13285
c1cc(c(cc1S(=O)(=O)O)C(=O)O)O.O.O 13286
c1cc(c(cc1S(=O)(=O)O)C(=O)O)O.O.O 26879
c1cc(c(cc1S(=O)(=O)O)C(=O)O)O.O.O 42451
c1cc(c(cc1S(=O)(=O)O)C(=O)O)O.O.O 61326
c1ccncc1.O=S(=O)=O 13287
COc1cc(cc(c1O)OC)C=O 13288
COc1cc(cc(c1O)OC)C(=O)O 13289
CCC(C)(C)OC 13305
CC(=O)N[C@@H](CSCc1ccccc1)C(=O)OC 13309
CCCCCCCC/C=C\CCCCCCCCCCCC(=O)N 13316
CCCCOc1c(=O)c(=O)c1OCCCC 13317
CN(C)CC(=O)c1ccc(c(c1)O)O.Cl 13318
CCCCCCC1(N(C(C(=[N+]1C)C)(C)C)[O])C.COS(=O)(=O)[O-] 13322
CC1(/C(=C\C(=O)c2ccccc2)/NC(N1[O])(C)C)C 13324
CC1(C(=NC(N1[O])(C)C)C(=O)[O-])C.[Na+] 13325
CC1(C(=NC(N1[O])(C)C)c2ccccc2)C 13326
CC1=NC(N(C1(C)C)[O])(C)C 13327
CC1(C(=[N+](C(N1[O])(C)C)[O-])C(=O)O)C 13330
CC1(C(=[N+](C(N1[O])(C)C)[O-])CBr)C 13331
CCC1=[N+](C(N(C1(C)C)C)(C)C)[O-] 13333
c1c(nc(s1)N)CC(=O)O 13338
c1ccc(c(c1)C(=O)Oc2ccccc2C(=O)O)O 13340
CC1=[N+](C(NC1(C)C)(C)C)[O-] 13342
CC1(C(=[N+](C(N1[O])(C)C)[O-])c2ccccc2)C 13343
CC1(C(=[N+](C(N1O)(C)C)[O-])c2ccccc2)C 13344
CC1=[N+](C(N(C1(C)C)[O])(C)C)[O-] 13345
CC1=[N+](C(N(C1(C)C)O)(C)C)[O-] 13346
C(CC(=O)O)CBr 13347
CC1=CC(=O)CC(C1(/C=C/C(=C\C(=O)O)/C)O)(C)C 13348
COC(CC#N)OC 13354
[2H]C(C([2H])(Cl)Cl)(Cl)Cl 13358
[2H]C(C([2H])(Cl)Cl)(Cl)Cl 32131
CC1CN(NC1=O)c2ccccc2 13359
CC(=O)NC12CC3CC(C1)CC(C3)C2 13360
c1ccc(cc1)Nc2cccc3c2cccc3.Br 13364
C1CNC(CN1)C(=O)O.Cl.Cl 13366
COc1cc(c(cc1C(=O)O)Cl)N 13367
CCOC(=O)[C@H](C)OS(=O)(=O)C 13369
N 13371
N 36838
N 36839
N 38844
[Na+].[Na+].[S-2] 13372
C(CCC[C@H]([C@H](CCCCCCO)O)O)CCCC(=O)O 13373
Cc1ccc(cc1)S(=O)(=O)OC[C@@H]2COC(O2)(C)C 13374
Cc1ccc(cc1)S(=O)(=O)OC[C@H]2COC(O2)(C)C 13375
CC(C)CC(C)(C(=O)O)N 13376
CC[C@H](C)[C@@H](C(=O)O)N 13377
CC[C@@H](C)[C@H](C(=O)O)N 13378
CC(C)(C)[C@H](C(=O)O)N 13379
C1COCCN1C=O 13380
CCOC(C)Oc1ccc(cc1)Br 13381
CCCCCCC(=O)CC 13384
Cc1ccc(cc1)S(=O)(=O)N2CCCC2=O 13387
Cc1ccc2cc[nH]c2c1 13388
Cc1cccc2c1cc[nH]2 13389
COc1cccc2c1cc[nH]2 13390
Cc1ccc(cc1)I 13394
CCc1ccc(nc1)C 13395
C([C@H](C(=O)O)N)SSC[C@H](C(=O)O)N 13398
Cc1ccc(c(c1)C(=O)OC)O 13399
C(CO)N(CCO)CCO.I 13400
CC1CN(CCC1=O)Cc2ccccc2 13404
c1ccc(cc1)C(=O)c2ccc(c(c2)Cl)Cl 13405
[OH-].[K+] 13406
[OH-].[K+] 20607
[OH-].[K+] 39606
[OH-].[K+] 23255
[OH-].[K+] 42414
[OH-].[K+] 61115
[OH-].[K+] 61168
[OH-].[K+] 61170
[OH-].[K+] 61173
[OH-].[K+] 61325
[OH-].[K+] 38062
CC(C)N1CCC(=O)CC1 13410
CC(=O)N(C)C=C 13412
CCCN1CCC(=O)CC1 13415
COc1ccc(c(c1)OC)Br 13417
c1cc(c(cc1Br)F)N 13418
CCOC(=O)N1C2CCC1CC(=O)C2 13420
c1ccc(cc1)CN2CCCC(C2)O.Cl 13425
c1cc(c(cc1Cl)Cl)CC(=O)O 13427
C1CCC(CC1)N2CCNCC2 13430
c1cnc(nc1)N2CCNCC2 13432
c1ccc(cc1)CCC(=O)Cl 13438
c1cc(c(cc1Cl)Cl)CCl 13439
[2H]C([2H])([2H])C([2H])([2H])OC([2H])([2H])C([2H])([2H])[2H] 13445
CNC(=O)/C=C\C(=O)O 13446
Cc1cc(nc(n1)C(C)C)O 13448
C1[C@@H]2C=C[C@H]1[C@@H]3[C@H]2C(=O)OC3=O 13451
c1ccc(cc1)NC(=O)/C=C/C(=O)O 13453
CC(=O)C1(CCNCC1)c2ccccc2.Cl 13458
COc1cc2cncc(c2cc1OC)Cc3ccc(cc3)Cl.CS(=O)(=O)O 13460
c1cc(cnc1)[O-].[Na+] 13461
C1CCC(CC1)N.Cl 13465
Cn1c(nnn1)[S-].O.O.[Na+] 13469
CC(=O)c1ccc2cc(ccc2c1)OC 13478
CC(CO)(CO)[N+](=O)[O-] 13480
CC(=O)c1cccc(c1)Cl 13484
CC(C)(c1ccc(cc1)Cl)C(=O)O 13485
c1cc(ccc1C(=O)CCC(=O)O)Cl 13486
c1ccc(cc1)C2(CCC(=O)CC2)C#N 13490
c1cc(c(cc1Cl)Cl)C2(CC2)C(=O)O 13492
c1cc(sc1)C(=O)c2ccc(cc2)F 13493
c1cc(ccc1C(c2ccc(cc2)F)Cl)F 13496
c1cc(c(cc1Cl)Cl)C2(CC2)C#N 13497
c1cc(c(cc1C(=O)C2CC2)[N+](=O)[O-])Cl 13499
c1cc(ccc1C2(CCCC2)C(=O)Cl)Cl 13502
CC(CN(C)C)C(=O)OC 13506
CC(CN(C)C)C(=O)OC 33876
CC1=NCCC1 13507
CN1CCOCC1.Cl 13511
c1cc2c(c(c1)[N+](=O)[O-])CCC2 13512
CC(=O)SCCSC(=O)C 13515
C(CC(=O)N)[C@H](C(=O)O)N 13516
c1ccc(cc1)CN2CCC(CC2)N.Cl.Cl 13517
COc1ccc(cc1)C(=O)CCCCl 13522
Cc1ccc(cc1)C(=O)CCCCl 13523
CCCCN(CCCC)CCC#N 13531
CCCCC(=O)c1ccc(cc1)F 13534
c1ccc(cc1)OCC2CO2 13535
CC(COC(=O)C)OC(=O)C 13540
Cc1ccc(cc1)S(=O)(=O)N(CCCl)CCCl 13543
Cc1cccc(c1NC(=O)CCl)C 13544
C1CCCN(CC1)CCO 13549
C1CCCN(CC1)CC#N 13561
CN(C)CCC#N 21545
c1ccc2c(c1)[nH]c(=O)n2C3=CCNCC3 13591
CC1(COCOC1)CO 13602
c1cc(ccc1C2=CCNCC2)F.Cl 13609
c1ccc(cc1)C(CCBr)c2ccccc2 13611
CC(=C)c1ccc(cc1)F 13612
CCCC(=O)OCc1ccccc1 13627
CCCCCCCCCCCc1ccccc1 13628
c1ccc(cc1)C(C2CC2)(C3CC3)O 13629
c1ccc(cc1)OCCCCCl 13633
c1cc2c(cc1Cl)sc(n2)N 13640
Cc1cccc(c1)N2CCNCC2.Cl.Cl 13647
c1cc(ccc1C(C(=O)O)O)Cl 38675
Cc1cc(ccc1[N+](=O)[O-])Cl 13664
CC(=O)c1ccc(c(c1)[N+](=O)[O-])Br 13677
c1ccc(cc1)CN2CCC(CC2)(C#N)O 13686
c1ccc2c(c1)OCC(O2)CBr 13687
c1cc(ccc1C(=O)CCl)Cl 13688
c1cc(ccc1C(=O)CCCCl)Cl 13689
Cc1cccc(c1C)N2CCNCC2 13693
Cc1ccc(c(c1)C)N2CCNCC2 13694
Cc1ccc(c(c1)N2CCNCC2)C 13695
Cc1ccc(cc1C)N2CCNCC2 13696
c1cc(ccc1OCCCCl)F 13697
c1cc(cc(c1)C(F)(F)F)C2(CCNCC2)O 13698
Cc1ccc(cc1N2CCNCC2)Cl 13699
CC(C)[P+](c1ccccc1)(c2ccccc2)c3ccccc3.[I-] 13708
CCCCNC(=O)NCCCC 13709
CCN(CC)CC(=O)Nc1c(cccc1C)C 13725
CO[Si](CCCCl)(OC)OC 13728
c1cc(cnc1)I 13744
c1cc(cc(c1)[N+](=O)[O-])C(=O)CBr 13747
c1cc(c(cc1C(F)(F)F)Br)Cl 13751
C(C(C(=O)O)O)(C(=O)O)O 13785
C(C(C(=O)O)O)(C(=O)O)O 42000
C(C(C(=O)O)O)(C(=O)O)O 13786
C(C(C(=O)O)O)(C(=O)O)O 13787
c1cc(ccc1C=O)C=O 13789
c1ccc(cc1)c2ccc(cc2)c3ccccc3 13792
c1ccc(cc1)c2ccc(cc2)c3ccccc3 42003
c1ccc(cc1)c2ccc(cc2)c3ccccc3 42004
c1(c(nc(nc1N)N)N)N.OS(=O)(=O)O 13793
c1(c(c(c(c(c1Br)Br)Br)Br)O)O 13794
c12c(c(c(c(c1Br)Br)Br)Br)C(=O)OC2=O 13795
c1(c(c(sc1Br)Br)Br)Br 13796
c1ccc(c(c1)C(Br)Br)C(Br)Br 13797
CCCC[Sn](CCCC)(CCCC)CCCC 13798
C1(=C(C(=O)C(=O)C(=C1Cl)Cl)Cl)Cl 13799
C(=C(Cl)Cl)(Cl)Cl 13801
C(=C(Cl)Cl)(Cl)Cl 16789
CCCCCCCCCCCCCCCCCCCCCCCC 13804
C(#N)C(=C(C#N)C#N)C#N 13805
CCCCCCCCCCCCC(C)O 13807
CCCCCCCCCCCCC=C 13808
CCCCCCCCCCCCCCN 13810
C(CNCCNCCNCCN)N 13811
CCN(CC)C(=S)SSC(=S)N(CC)CC 13812
c1cc(c(c(c1F)F)F)F 13813
c1c(cc(c(c1F)F)F)F 13814
c1c(c(cc(c1F)F)F)F 13815
c1ccc2c(c1)c3c([nH]2)CCCC3 13817
C1CC(OC1)CO 13818
C1CC(OC1)CO 42044
C1CCOC(C1)OCC2CCCO2 13819
c1ccc2c(c1)CCNC2 13820
c1cc2c(c(c1)O)CCCC2 13821
C1CCC2=C(C1)C(=O)OC2=O 13822
C1CCOC(C1)CO 13825
c1ccc2c(c1)CCCN2 13827
C1CCSC1 13828
c1ccc2c(c1)CCCC2=O 13831
c1ccc2c(c1)CCCC2=O 30046
C[N+](C)(C)C.[Cl-] 13833
C[N+](C)(C)C.F[P-](F)(F)(F)(F)F 13834
C[N+](C)(C)C.[OH-] 13835
C[N+](C)(C)C.[OH-] 42051
C[N+](C)(C)C.[OH-] 42052
[B-](F)(F)(F)F.C[N+](C)(C)C 13836
Cc1cc(c(cc1C)C)C 13837
Cc1cc(c(cc1C)C)C 40939
CN(C)c1ccc(cc1)c2ccc(cc2)N(C)C 13838
CC1(CC(=O)CC(C1)(C)C)C 13839
CN(C)CN(C)C 13840
C1CCC2(C1)CC(=O)OC(=O)C2 13842
C1CCS(=O)(=O)C1 13843
C1CCS(=O)C1 13844
CN(C)CCN(C)C 13845
CN(C)CCN(C)C 42058
CC(C)CCCC(C)CCCC(C)CCCC(C)C 13846
C[Si](C)(C)C 13847
C[Si](C)(C)C 26886
CN(C)C(=S)SSC(=S)N(C)C 13848
CN(C)C(=O)N(C)C 13849
CN(C)C(=O)N(C)C 42067
c1ccc(cc1)[As+](c2ccccc2)(c3ccccc3)c4ccccc4.O.[Cl-] 36695
[B-](c1ccccc1)(c2ccccc2)(c3ccccc3)c4ccccc4.[Na+] 13852
[B-](c1ccccc1)(c2ccccc2)(c3ccccc3)c4ccccc4.[Na+] 42445
c1ccc(cc1)C2=C(C(=C(C2)c3ccccc3)c4ccccc4)c5ccccc5 13853
c1ccc(cc1)C2=C(C(=O)C(=C2c3ccccc3)c4ccccc4)c5ccccc5 13854
c1ccc(cc1)C(=C(c2ccccc2)c3ccccc3)c4ccccc4 13855
c1ccc(cc1)C(c2ccccc2)(c3ccccc3)c4ccccc4 13857
c1cc(sc1)C(=O)CC(=O)C(F)(F)F 13861
c1ccc2c(c1)ccs2 13862
C1[C@H](NCS1)C(=O)O 13864
c1cc(sc1)CCCC(=O)O 13865
CSc1ccccc1 13867
c1ccc(cc1)C(=O)S 13868
c1ccc(cc1)NC(=S)Nc2ccccc2 13870
Cc1ccc(cc1)S 13871
C1CSSC1CCCCC(=O)O 13872
C(C(=O)O)SCC(=O)O 13874
C(CSCCC(=O)O)C(=O)O 13875
C1C(=O)NC(=S)N1 13876
CC(=O)S 13878
CC(C(=O)O)S 13879
c1cc(cnc1)C(=S)N 13880
c1ccsc1 13882
c1ccsc1 34259
c1cc(sc1)C=O 13883
c1cc(sc1)C(=O)O 13884
c1cc(sc1)C(=O)NN 13885
c1cc(sc1)CO 13886
c1ccc(cc1)S 13887
c1ccc(cc1)S 22004
c1ccc(c(c1)C(=O)O)S 13889
C(=S)(N)NN 13890
C(=S)(N)N 13891
C(=S)(N)N 22005
C(=S)(N)N 42454
c1ccc2c(c1)c(=O)c3ccccc3s2 13892
C[C@H]([C@@H](C(=O)O)N)O 13893
C[C@H]([C@@H](C(=O)O)N)O 13894
c1c(cc(c(c1I)Oc2cc(c(c(c2)I)O)I)I)C[C@@H](C(=O)[O-])N.[Na+] 13896
C/C=C(\C)/C(=O)O 13897
c1ccc(cc1)CC2=NCCN2.Cl 13898
Cc1cccc(c1)C=O 13899
Cc1ccc(cc1)C=O 13900
Cc1ccc(cc1)C=O 42114
Cc1ccc(cc1)S(=O)(=O)O.O 13902
Cc1ccc(cc1)S(=O)(=O)O.O 17178
Cc1ccc(cc1)S(=O)(=O)O.O 42121
Cc1ccc(cc1)S(=O)(=O)Cl 13903
Cc1ccccc1C(=O)O 13904
Cc1cccc(c1)C(=O)O 13905
Cc1ccc(cc1)C(=O)O 13906
Cc1ccc(cc1)C(=O)NN 13907
Cc1ccccc1N 13908
Cc1ccccc1N 18075
Cc1ccc(cc1)N 13909
Cc1ccc(cc1)N 37635
Cc1ccccc1CC(=O)O 13910
Cc1cccc(c1)CC(=O)O 13911
Cc1ccc(cc1)CC(=O)O 13912
Cc1ccc(cc1)SSc2ccc(cc2)C 13913
Cc1ccccc1NN.Cl 13914
Cc1cccc(c1)NN.Cl 13915
Cc1ccc(cc1)NN.Cl 13916
Cc1ccccc1N2CCNCC2 13917
Cc1ccc(cc1)S(=O)(=O)N[C@@H](CCCNC(=N)N)C(=O)OC.Cl 13920
CC(=O)OCC(COC(=O)C)OC(=O)C 13922
CC(=O)OC[C@@H]1[C@H]([C@@H](C=CO1)OC(=O)C)OC(=O)C 13924
c1c(nc(nc1N)N)N 13925
c1nc(c(c(n1)N)N)N.O.OS(=O)(=O)O 13926
C(=O)C(Br)(Br)Br 13929
C(=O)(C(Br)(Br)Br)O 13930
CCCCN(CCCC)CCCC 13932
CC(C)(C)c1cc(c(c(c1)C(C)(C)C)O)C(C)(C)C 13933
CCCCP(CCCC)CCCC 13934
CCCC[Sn](CCCC)(CCCC)Cl 13935
C(C(CC(=O)O)C(=O)O)C(=O)O 13936
C(#N)C(Cl)(Cl)Cl 13937
c1c(c(cc(c1Cl)Cl)Cl)N 13938
c1cc(c(c(c1)Cl)Cl)Cl 13939
c1c(cc(cc1Cl)Cl)Cl 13940
C(C(Cl)Cl)Cl 13943
C(C(Cl)(Cl)Cl)O 13944
c1cc(c(c(c1[N+](=O)[O-])Cl)Cl)Cl 13946
c1c(cc(c(c1Cl)O)Cl)Cl 13948
c1c(nc(nc1Cl)Cl)Cl 13949
c1cc(c(c(c1)Cl)CCl)Cl 13950
CCCCCCCCCCCCC 13951
CCCCCCCCCCCCC(=O)O 13952
CCCCCCCCCCCCCO 13953
CCCCCCCCCCCC=C 13954
CCCCCCCCCCCCCN 13955
C(CO)N(CCO)CCO 13956
C(CO)N(CCO)CCO 42163
B12OCCN(CCO1)CCO2 13957
B(OCC)(OCC)OCC 13958
C(COCCOCCO)O 13959
COCCOCCOCCOC 13960
CCOC(=O)CC(C(=O)OCC)C(=O)OCC 13961
CCOC(=O)C(C(=O)OCC)C(=O)OCC 13963
CCOC(C)(OCC)OCC 13965
CCOC(OCC)OCC 13966
CCOC(OCC)OCC 42169
CCC(OCC)(OCC)OCC 13967
CCOP(=O)(OCC)OCC 13968
CCOP(OCC)OCC 13969
CCOP(OCC)OCC 42172
CCOC(=O)CP(=O)(OCC)OCC 13970
CCOC(C(F)(F)F)O 13971
C(=O)(C(F)(F)F)O 13972
C(=O)(C(F)(F)F)O 29381
C(=O)(C(F)(F)F)[O-].[Ag+] 13973
CC(=O)C(F)(F)F 13974
C(C(F)(F)F)O 13975
c1ccc2c(c1)Nc3cc(ccc3S2)C(F)(F)F 13976
c1ccc(cc1)C(F)(F)F 13977
CC(=O)c1ccc(c(c1O)O)O 13978
CC(=O)c1c(cc(cc1O)O)O.O 13979
c1cc(ccc1C(=O)c2ccc(cc2O)O)O 13981
c1cc(ccc1C2CC(=O)c3c(cc(cc3O2)O)O)O 13982
C(CCO)CC(CO)O 13983
c1c(c(nc(n1)O)O)O 13984
c1c(c(nc(n1)O)O)O 33059
c1c(cc(c(c1I)I)I)C(=O)O 13985
c1cc(c(cc1Oc2c(cc(cc2I)C[C@@H](C(=O)[O-])N)I)I)O.[Na+] 13986
CC(C)OP(OC(C)C)OC(C)C 37238
CC(=O)c1cc(c(c(c1)OC)OC)OC 13989
COc1cc(cc(c1OC)OC)N 13990
COc1cc(cc(c1OC)OC)C=O 13991
COc1ccc(c(c1)OC)OC 13992
COc1cc(cc(c1OC)OC)C(=O)O 13993
COc1cc(cc(c1OC)OC)CO 13995
COc1cc(c(cc1OC)OC)/C=C/C(=O)O 13997
COc1cc(cc(c1OC)OC)/C=C/C(=O)O 13998
COc1cc(cc(c1OC)OC)CC(=O)O 13999
CC(C)(C)C(=O)N 14001
CC(C)(C)C(=O)O 14002
CC(C)(C)C#N 14003
Cc1cc(c(c(c1)C)C(=O)C)C 14004
CC(C)(C)C(=O)Cl 14005
CN(C)C.Cl 14007
Cc1ccc(c(c1)C)C 14009
Cc1cc(c(c(c1)C)C(=O)O)C 14011
B(OC)(OC)OC 14012
CC(=C)C(C)(C)C 14013
C1COC1 14014
Cc1cc(c(c(c1O)C)C)O 14015
CC1=Nc2ccccc2C1(C)C 14016
CC(=C)CC(C)(C)C 14018
Cc1cc(c(c(c1)O)C)C 14019
Cc1cc(c(c(c1)C)O)C 14021
COC(=O)CP(=O)(OC)OC 14023
C[S+](C)C.[I-] 14025
C[S+](=O)(C)C.[I-] 14026
CCCCCCCCN(CCCCCCCC)CCCCCCCC 14028
C1OCOCO1 14029
c1ccc(cc1)C(c2ccccc2)(c3ccccc3)C(=O)O 14030
c1ccc(cc1)N(c2ccccc2)c3ccccc3 14031
c1ccc(cc1)[Sb](c2ccccc2)c3ccccc3 14032
c1ccc(cc1)[As](c2ccccc2)c3ccccc3 14033
c1ccc(cc1)c2cc(cc(c2)c3ccccc3)c4ccccc4 14034
c1ccc2c(c1)c3ccccc3c4c2cccc4 14036
c1ccc(cc1)C=C(c2ccccc2)c3ccccc3 14037
c1ccc(cc1)c2c(nc([nH]2)c3ccccc3)c4ccccc4 14038
c1ccc(cc1)C(c2ccccc2)(c3ccccc3)Br 14039
c1ccc(cc1)C(c2ccccc2)(c3ccccc3)Cl 14040
c1ccc(cc1)C(c2ccccc2)(c3ccccc3)Cl 20766
c1ccc(cc1)C(c2ccccc2)(c3ccccc3)S 14041
c1ccc(cc1)P(c2ccccc2)c3ccccc3 14042
c1ccc(cc1)P(=O)(c2ccccc2)c3ccccc3 14043
c1ccc(cc1)OP(Oc2ccccc2)Oc3ccccc3 14044
c1ccc(cc1)OP(Oc2ccccc2)Oc3ccccc3 22008
C(CCl)N(CCCl)CCCl.Cl 14048
C(C(CO)(CO)N)O.Cl 22803
CC(CO)(CO)CO 14051
C1SCSCS1 14052
c1(nc(nc(n1)S)S)S 14053
C=CC1CCC(C(C1)C=C)C=C 14054
c1ccc(cc1)C(CO)C(=O)O 14055
CN1C2CCC1CC(C2)O 14056
CN1C2CCC1CC(=O)C2 14057
c1ccc(c(=O)cc1)O 14058
c1ccc2c(c1)c(c[nH]2)C[C@@H](C(=O)O)N 14059
c1ccc2c(c1)c(c[nH]2)CCO 14060
c1cc(ccc1CCN)O 14061
c1cc(ccc1CCN)O.Cl 14062
c1cc(ccc1CCN)O.Cl 42238
c1cc(cc(c1)O)CC(C(=O)O)N 14063
c1cc(ccc1C[C@@H](C(=O)O)N)O 14064
COC(=O)[C@H](Cc1ccc(cc1)O)N 14065
CCCCCCCCCCC 14066
C(CCCCCC(=O)O)CCCCCC(=O)O 36944
CCCCCCCCCCCO 14068
CCCCCCCCCC(=O)C 14069
CCCCCCCCCC(=O)C 29938
CCCCCCCCCCCN 14070
C=CCCCCCCCCCO 38899
CCCCCCCCCCC=O 14073
c1(=O)[nH]c(=O)[nH][nH]1 14074
C(=O)(N)N 14075
C(=O)(N)N 19746
C(=O)(N)N 32738
C(=O)(N)N 42458
c1cn(c(=O)[nH]c1=O)[C@H]2[C@@H]([C@@H]([C@H](O2)CO)O)O 14077
C1CCNC(=O)C1 14078
CC1CCC(=O)O1 14079
CCCCC(=O)c1ccccc1 14080
CC(C)[C@@H](C(=O)O)N 14081
COc1cc(ccc1O)C=O 14082
COc1ccc(cc1OC)CN 14083
CC(=O)OC=C 14084
C=Cc1c2ccccc2cc3c1cccc3 14085
C=CC1CCC=CC1 14088
C=Cc1ccc2ccccc2c1 14090
C=Cc1ccncc1 14091
C=CN1CCCC1=O 14092
C=CN1CCCC1=O 35473
CC(C)CCC[C@@H](C)[C@H]1CC[C@@H]\2[C@@]1(CCC/C2=C\C=C/3\C[C@H](CCC3=C)O)C 14094
c1ccc2c(c1)c(=O)c3ccccc3o2 14097
c1c(=O)[nH]c2c(n1)[nH]c(nc2=O)N.O 14098
Cc1ccccc1C 14099
C1[C@H]([C@@H]([C@H](C(O1)O)O)O)O 14100
c1ccc(cc1)[P+](Cc2ccc(cc2)C[P+](c3ccccc3)(c4ccccc4)c5ccccc5)(c6ccccc6)c7ccccc7.[Br-].[Br-] 14101
c1cc(cc(c1)CN)CN 14102
COC(=O)[C@H]1[C@H](CC[C@@H]2[C@@H]1C[C@H]3c4c(c5ccccc5[nH]4)CCN3C2)O.Cl 14103
COC[P+](c1ccccc1)(c2ccccc2)c3ccccc3.[Cl-] 14601
COc1ccc(cc1)C(c2ccccc2)(c3ccc(cc3)OC)Cl 14602
c1c(c(c(c(c1F)F)S)F)F 14607
CCOC(=O)C(=P(c1ccccc1)(c2ccccc2)c3ccccc3)C 14608
c1cc(cc(c1)O)N 14610
C1C2CC3CC1CC(C2)C3 14611
c1cc(c(c(c1)Cl)CO)Cl 14612
c1cc(c(c(c1)Cl)CBr)Cl 14613
C1CN2CCC1C(C2)N.Cl.Cl 14615
CCSCCC(C(=O)O)N 14617
CCSCCC(C(=O)O)N 39397
CC(C)NCC(c1ccc(c(c1)O)O)O.CC(C)NCC(c1ccc(c(c1)O)O)O.O.O.OS(=O)(=O)O 14619
CC(=O)NCCO 14620
c1cc(ccc1C(=O)O)N 14621
c1(c(c(c(c(c1F)F)N)F)F)C(=O)N 14622
c1cnnc(n1)N 14623
c1ccc(cc1)CC(C(=O)O)C(=O)O 14624
CSCc1ccccc1 14625
c1cc(ccc1N)Br 14628
c1cc(ccc1N)Br 40287
c1ccc2c(c1)C(=O)N(C2=O)CCCCBr 14629
c1ccc2c(c1)ccc(c2N=Nc3ccc(cc3)[N+](=O)[O-])O 14630
c1ccc2c(c1)ccc(c2/N=N/c3ccccn3)O 14631
C(c1c(c(c(c(c1F)F)F)F)F)Br 14633
c1cc(cc(c1)Br)O 14634
c1ccc(cc1)c2ccc(cc2)C(=O)CBr 14635
c1cc(ccc1C(=O)CBr)Cl 14636
c1ccc(cc1)C(c2ccccc2)c3ccccc3 14638
c1ccc2c(c1)ncs2 14639
c1ccc(cc1)Cl 14641
c1ccc(cc1)Cl 22211
c1ccc(cc1)Cl 40449
COc1ccccc1[N+](=O)[O-] 14643
CC(=O)OC[C@@H]1[C@H]([C@@H]([C@H]([C@H](O1)OC(=O)C)OC(=O)C)OC(=O)C)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)COC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C 14646
CCOP(=O)(NCCc1ccccc1)OCC 14647
c1cc(ccc1Cl)I 14648
Cc1c(cccc1Cl)N 14649
Cc1ccc(cc1Cl)N 14650
c1cc(c(cc1[N+](=O)[O-])Cl)N 14651
c1cc(c(cc1Cl)[N+](=O)[O-])N 14652
Cc1c(cccc1Cl)[N+](=O)[O-] 14653
c1ccc(c(c1)/C(=C\2/C=CC(=O)C(=C2)O)/c3ccc(c(c3)O)O)S(=O)(=O)O 14654
CCCC(=O)CCC 14655
C1CCC(CC1)C(=O)O 14656
c1(c(c(c(c(c1F)F)F)F)F)C(=O)c2c(c(c(c(c2F)F)F)F)F 14659
Cc1ccc(cc1N)N 14660
c1cc(c(cc1Cl)N)Cl 14661
c1ccc(cc1)C2CC(=O)c3ccccc3O2 14662
CCN(CC)c1cccc(c1)O 14663
Cc1cc2c(cc1N)[n+](c3cc(c(cc3n2)C)N)c4ccccc4.[Cl-] 14664
Cc1cc2c(cc1N)[n+](c3cc(c(cc3n2)C)N)c4ccccc4.[Cl-] 41921
C1CCN(CC1)C(=O)CC#N 14667
Cc1ccc(c(c1)N)C 14669
CC1CCCC(C1=O)C 14670
c1cc(ccc1CC#N)F 14672
c1cc(ccc1CC#N)F 38095
c1ccc2c(c1)CCCC2 14673
c1ccc2c(c1)CCCC2 18767
c1cc2c(cc1F)[nH]cc2CC(C(=O)O)N 14674
C(CO)O 14675
C(CO)O 29553
C(CO)O 41001
CC[n+]1c2ccccc2sc1/C=C(\C)/C=C/3\N(c4ccccc4S3)CC.[I-] 14676
CCOC(=O)c1ccc(cc1)F 14680
CCC(C(=O)O)C(=O)O 14681
CCNc1cccc(c1)C 14683
c1ccc(cc1)c2ccccc2F 14684
CC(=O)C1CC2CC1C=C2 14687
CCCCC(=O)C 14688
COc1ccc(cc1O)/C=C/C(=O)O 14689
CCCC(=O)CC 14690
c1cc(ccc1O)S(=O)(=O)c2ccc(cc2)O 14691
c1ccc(cc1)C(=O)c2ccccc2O 14692
Cc1cc2c(cc1C)nc3c(n2)c(=O)[nH]c(=O)[nH]3 14693
COc1ccc(c2c1cccc2)C=O 14694
C12C(C(=O)OC1=O)C3(C(=C(C2(C3(Cl)Cl)Cl)Cl)Cl)Cl 14695
Cc1c2c(ccn1)c3ccccc3[nH]2 14696
Cc1ccc2cc(ccc2n1)OC 14698
CNC1CCCCC1 14699
COC(=O)CCSC 14700
COc1ccc(cc1)[N+](=O)[O-] 14702
c1ccc(cc1)Nc2ccc(cc2)[N+](=O)[O-] 14703
c1ccc2c(c1)cccc2[N+](=O)[O-] 14704
c1cc(cc(c1)[N+](=O)[O-])CC(=O)O 14705
c1ccc(cc1)N=Nc2c3ccccc3ccc2O 14706
c1(c(c(c(c(c1F)F)F)F)F)N 14708
C(=O)c1c(c(c(c(c1F)F)F)F)F 14709
c1(c(c(c(c(c1F)F)F)F)F)C(=O)N 14710
c1(c(c(c(c(c1F)F)S(=O)(=O)Cl)F)F)F 14711
c1(c(c(c(c(c1F)F)F)F)F)C(=O)Cl 14712
c1(c(c(c(c(c1F)F)F)F)F)O 14713
c1ccc(c(c1)C(=O)Cl)Cl 14714
C1CCC(C1)CO 14715
c1ccc(cc1)Nc2cccc3c2cccc3 14716
C1CCNCC1 14718
C1CCNCC1 35491
CCC(=O)SCC[N+](C)(C)C.[I-] 14719
c1cc2c(nc1)nccn2 14720
C[C@@H]1CC[C@H](CC1)O 14722
CCOS(=O)(=O)c1ccc(cc1)C 14723
CCOS(=O)(=O)c1ccc(cc1)C 41045
c1c(c(c(c(c1F)F)N)F)F 14725
C1(=C(C(=O)C(=C(C1=O)F)F)F)F 14726
C(#N)c1c(c(c(c(c1F)F)C#N)F)F 14727
C(C(=O)Cl)Cl 14729
c1[nH]nc(n1)S 14730
c1ccc(c(c1)N=Nc2c3ccc(cc3cc(c2O)S(=O)(=O)[O-])S(=O)(=O)[O-])[As](=O)(O)O.[Na+].[Na+] 14731
COc1ccc(c(c1)C(=O)CBr)OC 14732
c1ccc(c(c1)N2C(=O)C=CC2=O)N3C(=O)C=CC3=O 14733
c1ccc2c(c1)ccc(c2c3c4ccccc4ccc3O)O 14735
CCOC(=O)c1ccncc1 14737
C[Si](c1ccccc1)(Cl)Cl 14738
C[SiH](Cl)Cl 14739
CCCCCCCCCCCCCCCCCC[Si](Cl)(Cl)Cl 14740
C=C[Si](Cl)(Cl)Cl 14742
C[Si](C=C)(Cl)Cl 14743
c1[nH]c2c(n1)c(ncn2)N 14744
c1[nH]c2c(n1)c(ncn2)N 34855
C(N=C=S)Cl 14747
c1ccc2cc(ccc2c1)C(=O)CBr 14748
CN(C)CCCCCCN(C)C 14749
c1ccc(c(c1)C(=O)c2cc(ccc2N)Cl)Cl 14750
Cc1c(c2cc(ccc2[nH]1)OC)CC(=O)O 14751
CC(C)c1ccc2c(c1)CC[C@@H]3[C@@]2(CCC[C@@]3(C)CN)C 14752
C(C(F)(F)F)(C(F)(F)F)O 14754
C(C(F)(F)F)(C(F)(F)F)O 29341
C(C(F)(F)F)(C(F)(F)F)O 35486
C(C(F)(F)F)(C(F)(F)F)O 35487
c1ccc(cc1)c2c3ccccc3c(o2)c4ccccc4 14758
CC(=O)C1(CC1)C 14763
c1cc(ccc1CCl)CCl 14766
c1ccc(cc1)OP(=O)(Oc2ccccc2)Oc3ccccc3 14767
c1ccc(cc1)OP(=O)(Oc2ccccc2)Oc3ccccc3 22092
C1CCC(CC1)O 14768
Cc1ccc(cc1)S(=O)(=O)N 14769
Cc1ccc(cc1)S(=O)(=O)N 21700
c1ccc(c(c1)C(=O)O)O 14770
c1ccc(c(c1)C(=O)O)O 41922
c1ccc2c(c1)C(=O)OC2(c3ccc(cc3)O)c4ccc(cc4)O 14771
c1ccc2c(c1)C(=O)OC2(c3ccc(cc3)O)c4ccc(cc4)O 41718
c1cc(c(cc1Cl)Cl)O 14772
c1cc(cc(c1)CCl)CCl 14773
C=C(CBr)Br 14774
c1cc(c[n+](c1)[O-])C(=O)O 14778
C(C([C@@H]1[C@@H]([C@@H]2[C@H](O1)O[C@@H](O2)C(Cl)(Cl)Cl)O)O)O 14779
c1cscc1Br 14780
C(=O)(C(F)(F)F)OC(=O)C(F)(F)F 14781
C(C(=O)O)N(CC(=O)[O-])CC(=O)[O-].[Na+].[Na+] 14783
C(C(=O)[O-])N(CC(=O)[O-])CC(=O)[O-].O.[Na+].[Na+].[Na+] 14784
C(CN(CC(=O)O)CC(=O)[O-])N(CC(=O)O)CC(=O)[O-].O.O.[Na+].[Na+] 14785
C(CN(CC(=O)O)CC(=O)[O-])N(CC(=O)O)CC(=O)[O-].O.O.[Na+].[Na+] 40997
C(CN(CC(=O)[O-])CC(=O)[O-])N(CC(=O)O)CC(=O)[O-].[Na+].[Na+].[Na+] 14786
CCn1c2ccccc2c3c1ccc(c3)N 14787
C1C2CC3CC1CC(C2)(C3)C(=O)O 14788
CCCCCCCCCCCCCCCCS(=O)(=O)[O-].[Na+] 41139
CCCCCCCCCCCCS(=O)(=O)[O-].[Na+] 14790
c1ccc(cc1)P(CCP(c2ccccc2)c3ccccc3)c4ccccc4 14791
C(=O)O 14793
C(=O)O 27048
C(=O)O 41077
C(=O)O 42375
C(C(Cl)Cl)(Cl)Cl 14794
c1ccc(cc1)C(C(c2ccccc2)Br)Br 14795
CC(CO)(CO)C(=O)O 14797
Cc1ccc(cc1)C(=O)Cl 14798
CC(=O)[C@]12C3[Fe]1456789([C@@H]3C4C52)C1C6[C@H]7C8[C@H]91 14799
[C@H]12C3[Fe]1456789(C2[C@@]4(C53)C(=O)O)C1[C@@H]6C7[C@@]8(C91)C(=O)O 14801
Cc1c(cccc1O)[N+](=O)[O-] 14803
c1cc-2c(cc1[N+](=O)[O-])C(=O)c3c2ccc(c3)[N+](=O)[O-] 14805
c1(c(c(c(c(c1Br)Br)Br)Br)Br)Br 14806
C[N+](C)(C)C.O.O.O.O.[F-] 14807
Cc1cccnn1 14808
c1cc(c(nc1)[N+](=O)[O-])O 14810
Cc1ccc(cn1)O 14811
C(C(CCl)O)O 14812
C[C@H](CCC(=O)O)[C@H]1CC[C@@H]2[C@@]1([C@H](C[C@H]3[C@H]2CC[C@H]4[C@@]3(CC[C@H](C4)O)C)O)C 14814
c1ccc(cc1)C(=O)N2CCC(=O)CC2 14815
c1ccc(c(c1)CCl)[N+](=O)[O-] 14816
C(Cl)(Cl)(Cl)Cl 16772
C(Cl)(Cl)(Cl)Cl 32658
C(Cl)(Cl)(Cl)Cl 14817
C(Cl)(Cl)(Cl)Cl 25853
c1ccc(cc1)CC=O 37091
C(C#N)C(=C(C#N)C#N)N 14819
c1cc(cnc1)C(=O)NN 14820
C1(=C(C(=O)C(=C(C1=O)Cl)[O-])Cl)[O-].[Hg+2] 14821
C1(=C(C(=O)C(=C(C1=O)Cl)[O-])Cl)[O-].[Hg+2] 41364
C(=O)[O-].[Na+] 14823
C(C(CO)(CO)COCC(CO)(CO)COCC(CO)(CO)CO)O 14824
CN(C)c1ccncc1 14827
c1cc2c(cc1O)c(c[nH]2)C[C@@H](C(=O)O)N 14829
c1ccc(c(c1)CBr)[N+](=O)[O-] 14831
COc1ccc(cc1N)S(=O)(=O)F 14833
c1ccc(cc1)C(=O)C(F)(F)F 14835
c1ccc(c(c1)/N=N\c2c(cc3cc(cc(c3c2O)O)S(=O)(=O)[O-])S(=O)(=O)[O-])[As](=O)(O)[O-].[Na+].[Na+].[Na+] 14837
Cc1ccc(cc1)S(=O)(=O)OCCCl 14838
c1ccc(cc1)COCc2ccccc2 14840
C(C(=O)N)Cl 14841
CC(=C)CCl 14842
CCOC(=O)Cc1ccccc1 14843
COC(=O)Cc1ccccc1 14844
c1cc2cccnc2c(c1)O.c1cc2cccnc2c(c1)O.O.OS(=O)(=O)O 14845
c1ccc(cc1)S(=O)(=O)Cl 14847
c1ccc(cc1)S(=O)(=O)Cl 14848
c1ccc(cc1)S(=O)(=O)N 14849
CCCCCCOC(=O)C 14850
C[N+](=O)[O-] 14851
C[N+](=O)[O-] 16786
C[N+](=O)[O-] 21337
C[N+](=O)[O-] 42401
c1ccc(cc1)/C=C/CO 14852
C(C(Cl)(Cl)Cl)(Cl)(Cl)Cl 14854
c1ccc(cc1)C(=O)Nc2ccccc2 14855
CC(C)(C)c1ccc2c(c1)C(=O)c3ccccc3C2=O 14856
Cc1ccc(c(c1)C)N 14857
c1ccc2c(c1)nc(c(n2)O)C(=O)O 14859
COC(CC(OC)OC)OC 14861
COC(=O)C(Cl)Cl 14862
COC(=O)CCl 14863
COC(=O)CC#N 14864
C(C#N)C(=O)N 14865
COC(OC)OC 14866
c1cc(sc1Br)Br 14868
c1cc(ccc1C(=O)O)Br 14870
c1ccc(cc1)P(=O)(c2ccccc2)O 14871
COS(=O)OC 14875
c1cc(ccc1S(=O)(=O)Cl)Br 14876
CC(=O)Oc1ccccc1 14877
CCCCCCCC(=O)C 14878
CCCCCCCC(=O)C 37853
C=CCNC(=S)N 14880
c1ccc2c(c1)nc(s2)N 14881
Cc1ccc2c(c1)nc(s2)C 14882
c1cc(c(cc1[N+](=O)[O-])N)N 14884
Cc1nc2ccccc2o1 14885
CC(C(=O)C)O 14886
CC(C(=O)C)O 41195
COC(=O)CCS 14887
COC(=O)CS 14888
C(C(=O)[O-])S.[Na+] 14889
C(CSSCCC(=O)O)C(=O)O 14890
CC(C)N 14892
c1cc2c(cc1Cl)nc(c(n2)Cl)Cl 14895
C1CC2C=CC1C3C2C(=O)OC3=O 14896
c1cc2c(c(c1)O)CCCC2O 37420
c1ccc(cc1)C(=O)[O-].[Na+] 14898
Cc1c(sc[n+]1Cc2cnc(nc2N)C)CCO.Cl.[Cl-] 14899
c1ccc2c(c1)C(=O)NS2(=O)=O 14900
CCC(=O)[O-].[Na+] 14901
CC(C)(C)S 14902
C1C2CC3CC1CC(C2)(C3)Br 14903
C(CBr)C#N 14904
CCC(=O)OC 14905
C(=N)(N)NN.C(=O)(O)O 14906
C1C2CC(C1C=C2)C=O 14910
C(I)(I)I 14912
c1ccc(cc1)C(=O)O 14913
c1ccc(cc1)C(=O)O 22180
c1ccc(cc1)C(=O)O 42347
c1ccc(c(c1)NN)Cl.Cl 14914
COc1ccc(cc1)S 14915
COC(=O)CC(=C)C(=O)OC 14916
c1[nH]c2c(n1)c(=O)[nH]c(=O)[nH]2 14917
CCCCCOC(=O)C 14918
C(O)S(=O)[O-].O.O.[Na+] 14919
CC(=C)C(=O)N 14920
CCCC(=O)Cl 14921
CCCC(=O)Cl 21701
COc1ccccc1C=O 14922
c1ccc2c(c1)ccc(c2O)C(=O)O 14923
Cc1ccc2c(c1)C(=O)c3ccccc3C2=O 14924
C1CC(=O)N(C1=O)Cl 14925
CCCCCCCCl 14926
c1ccc2c(c1)c(cc(c2N)O)S(=O)(=O)O 14927
c1ccc2c(c1)c(cc(c2N)O)S(=O)(=O)O 40085
CN(C)c1ccc(cc1)C=O 14928
CN(C)c1ccc(cc1)C=O 16876
CN(C)c1ccc(cc1)C=O 42363
c1[nH]c2c(n1)c(nc(n2)N)Cl 14929
CCC(=O)O 14930
CCC(=O)O 22013
CCCN 14931
CCCN 22061
CC(C)O 14932
CC(C)O 16788
CC(C)O 18413
CC(C)O 32696
CC(C)O 32727
CC(C)O 32793
CC(C)O 36440
CC(C)O 41279
CC(C)O 42383
CC(C)O 61008
CC(C)O 61043
CC(C)O 61111
CC(C)O 61319
CC(C)O 61324
CC(C)O 38391
CC(C)O 38392
CC(C)O 38971
Cc1ccccn1 14933
c1ccc(cc1)O 14934
c1ccc(cc1)O 18078
c1ccc(cc1)O 22175
c1ccc(cc1)O 32710
c1ccc(cc1)O 41717
c1ccc(cc1)O 32712
COCCOCCO 14937
CC(C)C[C@H](C)O 14938
C(CO)C#N 14939
C(CO)C#N 21702
CCN1CCOCC1 14940
CCC(CC)C(=O)O 14941
CCOCCOC(=O)C 14942
C=COCCCl 14943
CC(C)CC(=O)CC(C)C 14944
CCNCC 14945
CCNCC 37837
CC(C)NC(C)C 14946
CC(C)NC(C)C 21943
CC(C)NC(C)C 37830
CCOC(=O)C 14947
CCOC(=O)C 16781
CCOC(=O)C 23211
CCOC(=O)C 26835
CCOC(=O)C 32661
CCOC(=O)C 32690
CCOC(=O)C 32788
CCOC(=O)C 36435
CCOC(=O)C 42317
CCOC(=O)C 42368
CCOC(=O)C 61006
CCOC(=O)C 61017
CCOC(=O)C 61034
CCCO 14948
CCCO 23207
CCCO 38960
CC(=O)OC(=O)C 14949
CC(=O)OC(=O)C 22213
CC(=O)OC(=O)C 42323
CC=O 14951
CC#N 14952
CC#N 16765
CC#N 25856
CC#N 26826
CC#N 26827
CC#N 32573
CC#N 32668
CC#N 32675
CC#N 32681
CC#N 36431
CC#N 40013
CC#N 42325
CC#N 61001
CC#N 61022
CC#N 61096
CC#N 61110
CC#N 61514
CCC(CC)C=O 14953
C(C(CCl)Cl)Cl 14955
CCCCC=O 14956
CCCCC(=O)O 14957
C(CO)N 14958
C(COCCOCCOCCO)O 14959
CC(=O)[O-].[K+] 14960
CC(=O)[O-].[K+] 21710
CC(=O)[O-].[K+] 22015
CC(=O)[O-].[K+] 41817
CC(=O)[O-].[Na+] 14961
CC(=O)[O-].[Na+] 22089
CC(=O)[O-].[Na+] 32729
CC(=O)[O-].[Na+] 42425
CC1CO1 14962
CC1CO1 22016
C=CC#N 14963
CC(CN)O 14965
CC(C)CCC(=O)C 14966
CCC(=O)C 14967
CCC(=O)C 21301
CCC(=O)C 32791
CCC(=O)C 38957
CCC(=O)C 38943
CCCCOCCCC 14969
CCCCOC=C 14970
CCCCOCCOCCO 14971
CC(=O)OCCCC=C 14972
CCCCC1CCCCC1 14974
c1cc(ccc1/N=N/c2c(cc3cc(cc(c3c2O)O)S(=O)(=O)[O-])S(=O)(=O)[O-])[N+](=O)[O-].[Na+].[Na+] 14975
CCCC/C=C/CCCC 14979
CC1(CCCCC1)C 14980
CC1CCCC(C1O)C 14981
CC(C)CCC(C)C 14982
CCCC(C)(C)C 14983
CC=C1CCCCC1 14984
CCCC(CCC)O 14985
CC/C=C/C=C 14986
CCC/C=C/C 14990
CC(C)C(C)O 14993
CCC(C)C(C)O 14997
CCC(C)C=C 14998
CC/C=C/C 15000
C=CCCCO 15001
C=CCCCO 35224
C/C=C/C(C)O 15002
CCC(c1ccccc1)O 15003
CCCOCCC 15004
C=CC1CCCCC1 15006
CCc1ccc(cc1)Br 15007
C=CCC(CC=C)O 15009
CCCCC(C)(C)O 15010
CCCCC(=C)C 15011
CCCC(C)C=C 15012
c12c(nc(nc1[nH]c(=O)[nH]2)N)N.c12c(nc(nc1[nH]c(=O)[nH]2)N)N.O.O.OS(=O)(=O)O 15017
CCC1(CC(=O)NC(=O)C1)C 15018
c1cc(ccc1C(=O)Cl)Cl 15019
Cc1ccccc1Cl 15020
Cc1ccc(cc1)Cl 15021
c1cc(c(cc1Cl)Cl)C(=O)Cl 15022
c1cc(c(cc1C(=O)Cl)Cl)Cl 15023
c1cc(ccc1CCl)Cl 15024
CCOC(=O)c1ccc(cc1)O 15025
CCOC(=O)C(c1ccccc1)C(=O)OCC 15026
c1ccc(cc1)C(=O)NCC(=O)O 15027
CCCCC(C(=O)OCC)C(=O)OCC 15028
CC(=C)CO 15029
CC(C)(C(Cl)(Cl)Cl)O.CC(C)(C(Cl)(Cl)Cl)O.O 15030
CCN(CCO)CCO 15031
CC1(C2CCC(=C)C1C2)C 15032
Cc1ccc(c(c1)O)C(C)C 15033
CC(CC(C)(C)O)O 15034
CC(CC(C)(C)O)O 21945
c1ccc(c(c1)[N+](=O)[O-])Br 15035
c1ccc(cc1)C(C#N)c2ccccc2 15036
C/C(=N\O)/C(=O)C 15037
C/C(=N\O)/C(=O)C 40330
Cc1nc2ccccc2s1 15038
c1cc(c(cc1Cl)Cl)N 15039
CC(=O)c1ccc(cc1)O 15040
c1cc(ccc1CBr)Br 15041
C(=C(Cl)Cl)(C(=C(Cl)Cl)Cl)Cl 15042
c1cc(ccc1C(=O)Cl)[N+](=O)[O-] 15043
c1cc(ccc1C=O)Cl 15044
C/C(=C\c1ccccc1)/C=O 15047
CCOC(=O)CC(C)C 15048
CCOC(=O)c1ccccc1O 15049
CCC(=O)OCC 15050
CCCCCCCC(=O)OCC 15051
CCCCCCCCCCCC(=O)OCC 15052
CCOC(=O)/C=C/c1ccccc1 15053
CCOC(=O)CCC(=O)OCC 15054
CC.CC.c1ccc2ccccc2c1 15055
CCc1ccccn1 15056
CCc1ccncc1 15057
C([C@@H](C(=O)O)O)C(=O)O 15059
C([C@@H]1[C@H]([C@@H]([C@@H](C(O1)O)O)O)O)O 15060
C([C@@H]1[C@H]([C@@H]([C@H](C(O1)O)O)O)O)O 15061
c1c(nc[nH]1)CCN.Cl.Cl 15062
CCCCCCCCO 15063
COc1cc(ccc1N)[N+](=O)[O-] 15064
CC(C)CCOC(=O)C 15066
CCOC=O 15067
CC1=CC[C@@H](CC1=O)C(=C)C 15068
CC1=CC[C@@H](CC1=O)C(=C)C 37784
C(O)S(=O)(=O)[O-].[Na+] 15069
CCN(CC)CCN 15070
c1cc(ccc1N)S(=O)(=O)O 15071
c1cc(ccc1N)S(=O)(=O)O 41984
CC(=O)Nc1ccc(cc1)S(=O)(=O)Cl 15072
COC(=O)CCC(=O)OC 15073
c1ccc(cc1)Nc2ccccc2 15074
c1ccc(cc1)Nc2ccccc2 22192
c1ccc(cc1)Nc2ccccc2 42365
C1C=CC2C1C3CC2C=C3 15076
Cc1c(c(c(cn1)CO)CO)O.Cl 15077
CCOC(=O)c1ccc(cc1)N 15078
CCCCS 15080
CCCCS 22062
CC(=O)Nc1ccccc1 15081
CC(C)(C)c1cc(ccc1O)O 15082
Cc1cc(ccc1O)O 15083
CC(C)(C)c1cc(c(cc1O)C(C)(C)C)O 15084
COc1ccc(c(c1)N)OC 15085
CC(C)OC(=O)C 15086
CC(C)OC(=O)C 18080
CC(C)OC(=O)C 38950
C/C=C/C(=O)O 15087
CCCC(=O)OCC(COC(=O)CCC)OC(=O)CCC 15088
C(=O)(C(=O)Br)Br 15089
CC[N+](CC)(CC)CC.[Cl-] 15090
c1ccc(cc1)C[C@@H](C(=O)O)O 15092
c1cc(ccc1C(c2ccc(cc2)Cl)O)Cl 15094
CC(C)Cc1ccccc1 15096
CCCCCc1ccccc1 15097
CCCCCCCc1ccccc1 15098
CCCCCCCCc1ccccc1 15099
CCCCCCCCCc1ccccc1 15100
CCCCCCCCCCCCc1ccccc1 15102
CC(C)(C)c1ccc(cc1)C(C)(C)C 15105
COc1cc(cc(c1OC)OC)CC#N 15106
C[Si](C)(c1ccccc1)Cl 15107
CCO[Si](CCCN)(OCC)OCC 15108
c1cc(ncc1[N+](=O)[O-])NCCN 15110
CCCNc1ccc(cn1)[N+](=O)[O-] 15111
c1cc(c(nc1)N)[N+](=O)[O-] 15112
c1ccc(cc1)[Sn](c2ccccc2)(c3ccccc3)O[Sn](c4ccccc4)(c5ccccc5)c6ccccc6 15113
c1cc(ccc1C(=O)c2ccc(cc2)Cl)Cl 15115
c1cc(cc(c1)Cl)Cl 15118
c1c(cc(cc1N)N)C(=O)O.Cl.Cl 15119
c1c(cc(c(c1[N+](=O)[O-])N)Br)[N+](=O)[O-] 15122
C1C2C=CC1C(C2C(=O)Cl)C(=O)Cl 15124
c1ccc(cc1)[Si](c2ccccc2)(c3ccccc3)Cl 15125
*=c1cc-2oc3cc(c(c(c3nc2c(c1*)C)C)c4c(cc(cc4O)O)C)* 41657
CC(=O)Cl 15127
CC(=O)Cl 21947
CC(=O)Cl 38774
c1cc(ccc1CC(=O)C(=O)O)O 15130
Cc1c(cc(c(c1Br)O)Br)C2(c3ccccc3S(=O)(=O)O2)c4cc(c(c(c4C)Br)O)Br 15131
Cc1c(cc(c(c1Br)O)Br)C2(c3ccccc3S(=O)(=O)O2)c4cc(c(c(c4C)Br)O)Br 32700
Cc1c(cc(c(c1Br)O)Br)C2(c3ccccc3S(=O)(=O)O2)c4cc(c(c(c4C)Br)O)Br 40293
Cc1c(cc(c(c1Br)O)Br)/C(=C/2\C=C(C(=O)C(=C2C)Br)Br)/c3ccccc3S(=O)(=O)[O-].[Na+] 15132
Cc1c(cc(c(c1Br)O)Br)/C(=C/2\C=C(C(=O)C(=C2C)Br)Br)/c3ccccc3S(=O)(=O)[O-].[Na+] 40294
Cc1cc(cc(c1O)Br)C2(c3ccccc3S(=O)(=O)O2)c4cc(c(c(c4)Br)O)C 15133
Cc1cc(cc(c1O)Br)C2(c3ccccc3S(=O)(=O)O2)c4cc(c(c(c4)Br)O)C 61283
c1ccc2c(c1)C(OS2(=O)=O)(c3cc(c(c(c3)Br)O)Br)c4cc(c(c(c4)Br)O)Br 15134
c1ccc2c(c1)C(OS2(=O)=O)(c3cc(c(c(c3)Br)O)Br)c4cc(c(c(c4)Br)O)Br 40314
c1ccc2c(c1)C(OS2(=O)=O)(c3cc(c(c(c3)Br)O)Br)c4cc(c(c(c4)Br)O)Br 40315
c1ccc(c(c1)C(=C2C=C(C(=O)C(=C2)Br)Br)c3cc(c(c(c3)Br)O)Br)S(=O)(=O)[O-].[Na+] 15135
c1ccc(c(c1)C(=C2C=C(C(=O)C(=C2)Br)Br)c3cc(c(c(c3)Br)O)Br)S(=O)(=O)[O-].[Na+] 40316
Cc1c(cc(c(c1Br)O)C(C)C)C2(c3ccccc3S(=O)(=O)O2)c4cc(c(c(c4C)Br)O)C(C)C 15136
Cc1c(cc(c(c1Br)O)C(C)C)C2(c3ccccc3S(=O)(=O)O2)c4cc(c(c(c4C)Br)O)C(C)C 40325
Cc1c(cc(c(c1Br)O)C(C)C)/C(=C/2\C=C(C(=O)C(=C2C)Br)C(C)C)/c3ccccc3S(=O)(=O)[O-].[Na+] 15137
Cc1c(cc(c(c1Br)O)C(C)C)/C(=C/2\C=C(C(=O)C(=C2C)Br)C(C)C)/c3ccccc3S(=O)(=O)[O-].[Na+] 40326
Cc1c(cc(c(c1Br)O)C(C)C)/C(=C/2\C=C(C(=O)C(=C2C)Br)C(C)C)/c3ccccc3S(=O)(=O)[O-].[Na+] 61240
Cc1cc(ccc1O)C2(c3ccccc3S(=O)(=O)O2)c4ccc(c(c4)C)O 15138
Cc1cc(ccc1O)/C(=C/2\C=CC(=O)C(=C2)C)/c3ccccc3S(=O)(=O)[O-].[Na+] 15139
Cc1cc(ccc1O)/C(=C/2\C=CC(=O)C(=C2)C)/c3ccccc3S(=O)(=O)[O-].[Na+] 61314
CN(C)c1ccc(cc1)N=Nc2ccccc2 15140
CN(C)c1ccc(cc1)N=Nc2ccccc2C(=O)[O-].[Na+] 15141
CN(C)c1ccc(cc1)N=Nc2ccccc2C(=O)[O-].[Na+] 41484
CN(C)c1ccc(cc1)N=Nc2ccccc2C(=O)[O-].[Na+] 61264
CN(C)c1ccc(cc1)N=Nc2ccc(cc2)S(=O)(=O)[O-].[Na+] 15142
CN(C)c1ccc(cc1)N=Nc2ccc(cc2)S(=O)(=O)[O-].[Na+] 21519
CN(C)c1ccc(cc1)N=Nc2ccc(cc2)S(=O)(=O)[O-].[Na+] 41465
CN(C)c1ccc(cc1)N=Nc2ccc(cc2)S(=O)(=O)[O-].[Na+] 41466
CN(C)c1ccc(cc1)N=Nc2ccc(cc2)S(=O)(=O)[O-].[Na+] 61128
c1ccc2c(c1)C(OS2(=O)=O)(c3ccc(cc3)O)c4ccc(cc4)O 15143
c1ccc2c(c1)C(OS2(=O)=O)(c3ccc(cc3)O)c4ccc(cc4)O 41724
c1ccc2c(c1)C(OS2(=O)=O)(c3ccc(cc3)O)c4ccc(cc4)O 61178
c1ccc(c(c1)C(=C2C=CC(=O)C=C2)c3ccc(cc3)O)S(=O)(=O)[O-].[Na+] 15144
c1ccc(c(c1)C(=C2C=CC(=O)C=C2)c3ccc(cc3)O)S(=O)(=O)[O-].[Na+] 41725
Cc1cc(c(cc1C2(c3ccccc3S(=O)(=O)O2)c4cc(c(cc4C)O)C(C)C)C(C)C)O 15145
Cc1cc(c(cc1C2(c3ccccc3S(=O)(=O)O2)c4cc(c(cc4C)O)C(C)C)C(C)C)O 42093
Cc1cc(c(cc1C2(c3ccccc3C(=O)O2)c4cc(c(cc4C)O)C(C)C)C(C)C)O 15146
Cc1cc(c(cc1C2(c3ccccc3C(=O)O2)c4cc(c(cc4C)O)C(C)C)C(C)C)O 42095
CN(C)c1ccc(cc1)/C=C/2\C(=O)NC(=S)S2 15147
c1ccc2c(c1)C(=O)C(=O)N2 15149
c1cc(ccc1N=Nc2ccc(cc2O)O)[N+](=O)[O-] 15151
c1cc(ccc1NN)[N+](=O)[O-] 38303
c1ccc2c(c1)ccc(c2N=O)O 15153
c1ccc2c(c1)ccc(c2O)N=O 15154
c1ccc(cc1)NN.Cl 15155
c1cc(ccc1/N=N\c2c(cc3cc(cc(c3c2O)O)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+] 15157
CCOC(=O)c1ccccc1C(=C2C=C(C(=O)C(=C2)Br)Br)c3cc(c(c(c3)Br)[O-])Br.[K+] 15158
c1c(cc(c(c1O)O)O)c2c(c(=O)c3c(cc(cc3o2)O)O)O 15159
c1cc(ccc1CCBr)[N+](=O)[O-] 15162
c1ccc(cc1)C(=O)C2CC3CC2C=C3 15163
C(=S)(Cl)Cl 15164
CN(C)C(=S)N(C)C 15165
CC(=O)OC[C@@H]1[C@H]([C@H]([C@@H](O1)n2c(=O)[nH]c(=O)cn2)OC(=O)C)OC(=O)C 15166
C1C2CC3CC1CC(C2)(C3)N.Cl 15167
C(=O)(N)NO 15168
c1cc(c(c(c1)Cl)[N+](=O)[O-])C(=O)O 15169
c1cc(cc(c1)Cl)CCl 15170
c1cc(c(cc1C(=O)O)C(=O)O)Br 15172
c1cc(c(cc1C(=O)O)Br)C(=O)O 36981
c1cc(cc(c1)C=O)C=O 15174
CNCCc1c[nH]c2c1cccc2 15175
COc1ccc2c(c1)c(c[nH]2)CC(C(=O)O)N 15176
c1cc(ccc1C(=O)c2ccc(cc2)F)F 15179
c1ccc(cc1)c2ccc(cc2)c3ccc(cc3)[N+](=O)[O-] 15180
c1cn(cn1)C(=O)n2ccnc2 15181
C[C@H](c1ccccc1)N 15182
C[C@H](c1ccccc1)N 37146
C[C@@H](c1ccccc1)N 15183
C[C@@H](c1ccccc1)N 37145
c1c[nH]c(=S)[nH]c1=O 15184
CCCCCC=O 15185
c1cc(c(cc1Cl)C#N)[N+](=O)[O-] 15186
c1cc(ccc1C#N)Cl 15187
c1cc2c(cc1C#N)OCO2 15188
COc1ccc(cc1)C(=O)CBr 15190
COc1cccc(c1)C(=O)CBr 15191
CC1(CC(CC(N1)(C)C)N)C 15193
CC1(CC(CC(N1)(C)C)O)C 15194
CC1(CCCC(N1)(C)C)C 15195
CC1(CC(=O)CC(N1)(C)C)C.Cl 15196
CN1CCc2cc(c(cc2C1Cc3ccc(c(c3)O)O)O)O.O.O.O.Br 15197
CC(=O)NCCCC[C@@H](C(=O)O)N 15198
c1ccc(c(c1)c2ccccc2O)O 15199
c1ccc(cc1)C(=O)CBr 15201
Cc1c(cccc1[N+](=O)[O-])N 15202
Cc1cccc(c1Br)C 15203
CC(C)CCS 15205
c1ccc(cc1)C(=O)C#N 38366
COC(=O)c1cc(cc(c1)C(=O)OC)C(=O)OC 15207
c1ccc(c(c1)C=O)C(=O)O 15208
c1ccc(cc1)C(C#N)O 15209
C[N+]1(CCOC(C1)(c2ccccc2)O)C.[Br-] 15210
C1CCN(CC1)CCO 15211
CCOC(=O)/C=C/CP(=O)(OCC)OCC 15212
C(=O)(C(Cl)(Cl)Cl)O 15213
C(=O)(C(Cl)(Cl)Cl)O 42145
CC[C@H](C(=O)O)N 15214
CCOP(=O)(C=C)OCC 15215
c1cc(c(nc1)Br)O 15217
c1cc(c(nc1)Cl)O 15218
CCOc1cccnc1[N+](=O)[O-] 15219
COc1ccc(c(c1)[N+](=O)[O-])Cl 15222
Cc1cccc(n1)Cl 15223
CC(=O)C1(CCOC1=O)C 15224
c1ccc(cc1)Cn2ccnc2 15225
CC(=O)Nc1ccc(cc1)c2ccc(cc2)F 15228
c1ccc(cc1)COc2ccc(cc2)N.Cl 15229
CC1C(=O)CCC1=O 15232
C[N+](C)(C)CCBr.[Br-] 15235
CC(=O)c1ccc(cc1)OC 15236
COc1ccc(cc1)C(=O)O 15237
Cc1ccc(cc1)S(=O)(=O)F 15238
CC(CN)N 15240
CC(CN)N 21948
Cc1ccccc1C=O 15243
C/C(=C/C#N)/N 15245
C#Cc1ccccc1 15246
COc1cccc(c1)C(=O)O 15247
C1C2CC3CC1CC(C2)(C3)C(=O)Cl 15248
CC(=C)OC(=O)C 15250
CCCCCBr 15252
C/C=C/c1ccc(cc1)OC 15253
c1ccc(cc1)C(=O)c2cc(ccc2Cl)[N+](=O)[O-] 15254
c1ccc(cc1)Nc2ccc(cc2[N+](=O)[O-])[N+](=O)[O-] 15255
c1ccc(cc1)C(=O)c2ccc(c(c2)[N+](=O)[O-])Cl 15256
c1ccc(c(c1)CC#N)C#N 15257
c1ccc(cc1)CC(=O)NC(=O)N 15258
C1C(=O)NC(=S)S1 15260
C=CCCCCCCC=C 15261
CCCCCCCCC(C)O 15262
CCCCCCCCC(C)O 33160
CCCCCCC(CCC)O 15263
C[C@@H]1CCC[C@@H](C1)C 15265
CCC(C)(C)CC 15266
C=CCC(C=C)O 15267
c1cc(cc(c1)Br)/C=C/C(=O)O 15269
Cc1ccc(c(n1)I)O 15270
CC(C)(C)C=C 15272
CCCCCCCCCCCCCCCCCCOP(=O)OCCCCCCCCCCCCCCCCCC 15273
CN1C2CC(C1CC(=O)C2)O 15274
COC1C=CC(O1)(C(=O)OC)OC 15275
CC(C)c1cc(c(c(c1)C(C)C)S(=O)(=O)Cl)C(C)C 15279
C[C@]12CCC(=O)C=C1CC[C@@H]3[C@@H]2CC[C@]4([C@H]3CC[C@@]4(C(=O)CO)O)C 15280
C(CCl)OP(=O)(OCCCl)OCCCl 15281
CNc1ccc(cc1)C(=O)O 15282
CCC(C)c1cccc(c1O)C(C)CC 15283
CC(=O)c1ccc(cc1)N2CCCCC2 15284
Cc1ccccc1C#N 15286
c1ccc(c(c1)c2c3cc(c(c(c3oc-4c(c(=O)c(cc24)Br)Br)Br)[O-])Br)C(=O)[O-].[Na+].[Na+] 15288
c1ccc(c(c1)c2c3cc(c(c(c3oc-4c(c(=O)c(cc24)Br)Br)Br)[O-])Br)C(=O)[O-].[Na+].[Na+] 20193
c1ccc(c(c1)c2c3cc(c(c(c3oc-4c(c(=O)c(cc24)Br)Br)Br)[O-])Br)C(=O)[O-].[Na+].[Na+] 40943
c1ccc(c(c1)c2c3cc(c(c(c3oc-4c(c(=O)c(cc24)Br)Br)Br)[O-])Br)C(=O)[O-].[Na+].[Na+] 61181
CC(=O)c1ccc(cc1)N2CCOCC2 15290
CC(=O)c1ccc(cc1)N2CCN(CC2)C 15291
Cc1cc(=O)oc2c1cc(c(c2)O)O 15292
c1cc\2c(cc1S(=O)(=O)[O-])C=C/C(=O/[Fe+3](/O=C\3/C=Cc4cc(ccc4/C3=N\[O-])S(=O)(=O)[O-])/O=C\5/C=Cc6cc(ccc6/C5=N\[O-])S(=O)(=O)[O-])/C2=N/[O-].[Na+].[Na+].[Na+] 15293
c1cc(ccc1C(=O)Cl)F 15295
c1cc(ccc1[N+](=O)[O-])S(=O)(=O)N 15302
c1ccc2c(c1)c(ccc2S(=O)(=O)[O-])N=Nc3c4ccc(cc4cc(c3O)S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+] 15303
CC(Cc1ccc(cc1)O)(C(=O)O)N 15306
COc1cccc(c1O)C=O 15307
Cc1c([nH]c2c1cccc2)C 37786
c1ccc(c(c1)C(=O)Cl)F 15309
c1cc(ccc1C(=O)Cl)C(=O)Cl 15310
c1c(cc(c(c1C(=O)O)I)I)I 15311
C(C(C(C=O)O)O)O 37280
Cc1ccc(cc1)S(=O)(=O)N(CCO)CCO 15314
c1cc(ccc1S(=O)c2ccc(cc2)Cl)Cl 15315
c1cc(ccc1C(C2CC2)O)F 15316
CC(C#N)(c1ccccc1)c2ccccc2 15317
c1c(cc(cc1[N+](=O)[O-])[N+](=O)[O-])C(=O)O 15319
Cc1ccccc1N=Nc2ccc(c(c2)C)N 15326
C1CC=C(C1)CC#N 38367
C(C=O)C(C(CO)O)O 15328
c1ccc(c(c1)C(=O)N)F 15329
CCCCNCC#N 15330
Cc1ccc2ccc3ccc(nc3c2n1)C 15332
c1ccc(c(c1)/C(=C/2\C=C(C(=O)C(=C2O)O)Br)/c3cc(c(c(c3O)O)O)Br)S(=O)(=O)O 15333
COC(CN)OC 15334
c1cc(ccc1C(=O)C2CCC2)F 15336
Cc1ccccc1C(=O)Cl 15337
CC(=O)/C=C/OC 15339
c1c(cc(c(c1C=O)O)Br)Br 15340
Cc1cccc(c1)C(=O)Cl 15341
CC(CN(CCN(CC(C)O)CC(C)O)CC(C)O)O 15342
c1ccc2c(c1)ccc[n+]2[O-] 15343
c1cc2ccc[n+](c2c(c1)O)[O-] 15344
c1ccc2c(c1)C(CCO2)O 15345
c1ccc2c(c1)C(=O)CCO2 15346
c1ccc2c(c1)CCCC2O 15349
C([C@H](C(=O)O)O)C(=O)O 15350
c1ccc2c(c1)c(ccc2N)C#N 15351
C(=O)[C@]12C3[Fe]1456789([C@@H]3C4C52)C1C6[C@H]7C8[C@H]91 15353
c1ccc(cc1)C(=O)[C@]23C4[Fe]2567891([C@@H]4C5C63)C2C7[C@H]8C9[C@H]12 15354
c1cc(c(nc1)O)O 15356
c1cc(c(nc1)N)O 15357
c1cc(c[n+](c1)[O-])O 15358
CCOC(=O)CCC(=O)C 15362
CC1(OCC(O1)CO)C 15365
CC(=O)c1ccc(cc1)c2ccccc2 15366
C(/C(=C/C(=O)O)/C(=O)O)C(=O)O 15367
CCOC(=O)CCCCC(=O)O 15368
c1ccc2c(c1)C(=O)c3ccc(c(c3C2=O)O)O 15369
C=CCS 15371
C(C#N)N.OS(=O)(=O)O 15372
c1ccc(c(c1)CO)N 15373
c1cc(ncc1Br)N 15374
Cc1cc(nc(n1)N)Cl 15375
C(CS)N.Cl 15377
c1cc(ccc1C(=O)NCC(=O)O)N 15380
C1CN(CCN1CCO)N 15381
c1cc2c(ccc(c2S(=O)(=O)O)N)c(c1)S(=O)(=O)O 15382
C(CCN)CCO 38791
c1cc(ccc1CCN)N 15384
c1cc2c(c(c1)N)c(=O)[nH][nH]c2=O 15385
Cc1ccnc(c1)N 15386
C1COCCN1CCCN 15387
c1csc(n1)N 15389
c1ccc(c(c1)N)S 15390
C(CCN)CC(=O)O 15391
COc1ccccc1 15392
c1ccc2c(c1)cc3ccccc3c2C=O 15393
c1ccc2c(c1)cc3ccccc3c2C=O 34680
c1cc(c(cc1/C(=C\2/C=CC(=O)C(=C2)C(=O)O)/c3ccc(c(c3)C(=O)O)O)C(=O)O)O 15395
C1CCCC(=O)NCCC1 15396
c1c(=O)[nH]c(=O)[nH]n1 15397
c1ccc2c(c1)cncn2 15398
CCCCCC(=O)C 15400
c1(c(c(=O)c1=O)O)O 15402
C1CC[C@H]2[C@@H](C1)C(=O)OC2=O 15403
c1ccc(cc1)C(Br)Br 15404
c1ccc(cc1)S(=O)[O-].[Na+] 15405
c1ccc2cc-3c(cc2c1)Cc4c3cccc4 15406
c1ccc2c(c1)ccc3c2nccc3 15407
CC(=O)Nc1ccccc1C(=O)c2ccccc2 37716
c1ccc(cc1)C(=O)c2ccncc2 15409
c1ccc(cc1)COc2ccc(cc2)C=O 15411
c1ccc(cc1)CN2CCCC2=O 15412
c1ccc(cc1)c2ccc(cc2)CO 15413
c1ccc(c(c1)CCl)CCl 15414
c1cc(ccc1C(=C(Cl)Cl)c2ccc(cc2)Cl)Cl 15415
c1cc(ccc1C(Cl)(Cl)Cl)C(Cl)(Cl)Cl 15417
CC12CCC(C1(C)CS(=O)(=O)[O-])C(C2=O)Br.[NH4+] 15419
c1cc(cc(c1)Br)Cl 15420
CCBr 15421
CCBr 33035
c1ccc-2c(c1)Cc3c2ccc(c3)Br 15422
Cc1ccc(c(c1)Br)N 15424
CC(C)CCBr 15425
CC(C)CCBr 40305
Cc1ccc2ccccc2c1Br 15426
c1ccc2c(c1)cc(cn2)Br 15427
C=Cc1ccc(cc1)Br 15428
c1cc(sc1)Br 15429
C1C(O1)COCCCCOCC2CO2 15431
CCCCOc1ccc(cc1)C(=O)O 15432
CCCCOCCO 15433
CCCCOCCO 40338
CCCCOCCO 40339
CC(C)(C)OC(=O)CBr 15434
CC(C)(C)c1ccc(c(c1)O)O 15435
CCCCN(CCO)CCO 15436
CC(C)(C)c1cccc(c1)O 15438
CCCC(=O)c1ccccc1 15441
C1CCC(=NNC(=O)C(=O)NN=C2CCCCC2)CC1 15442
C[N+](=c1ccc-2nc3c(cc(c(c3oc2c1)O)O)C(=O)O)C.[Cl-] 15443
c1ccc(cc1)NNC(=O)N=Nc2ccccc2 15445
c1ccc2c(c1)CC(=O)O2 15446
Cc1ccc(cc1)C(=O)c2ccccc2N 15447
c1cc(ccc1CC#N)Br 15448
C=CCCCCCCCCC(=O)O 15449
C(CC(C(=O)O)N)CC(=O)O 15450
C(C(=O)O)O 15451
C(C(=O)O)O 41103
c1cc(ccc1C#N)C(=O)Cl 15455
c1ccc2c(c1)cc(c(c2Cc3c4ccccc4cc(c3O)C(=O)[O-])O)C(=O)[O-].[Na+].[Na+] 15456
CC1(C2CCC1(C(=O)C2=O)C)C 15457
c1cc(ccc1C=O)C(=O)O 15458
CC1=CC[C@H](CC1=O)C(=C)C 15459
c1c(=O)cc(oc1C(=O)O)C(=O)O.O 15460
c1ccc(c(c1)C=O)Cl 15461
CCCCCl 15463
CCCCCl 40455
c1cc(sc1)C(=O)CCCCl 15464
c1ccc(cc1)C(c2ccccc2)Cl 15466
Cc1ccc(c(c1)Cl)N 15467
Cc1cccc(c1C#N)Cl 15468
c1cc(c(cc1[N+](=O)[O-])C(=O)O)Cl 15469
Cc1ccc(cc1Cl)[N+](=O)[O-] 15470
CCCCCCCCCl 15471
C(CS(=O)(=O)Cl)CCl 15473
c1cc(ccc1S)Cl 15476
C(CCCl)CC(=O)Cl 15477
CCCCCCCC(=O)O[C@H]1CC[C@@]2([C@H]3CC[C@]4([C@H]([C@@H]3CC=C2C1)CC[C@@H]4[C@H](C)CCCC(C)C)C)C 15478
CC1=CC(=O)OC1=O 15479
C/C=C/CCl 15480
C1C=CCC=C1 15482
C1CC(=O)CCC1=O 15483
C1CCC=CC1 15484
C1CCC/C=C\CC1 15486
C1CCC(C1)CC(=O)O 15487
C1CC1N 15488
C1CC1N 26368
c1ccc(cc1)C(=O)C2CC2 15489
C(CNCC(=O)O)C#N 15490
c1cc2c(cc1Cl)nc(s2)S 36837
C1CC(CCC1CO)CO 15492
c1ccc(cc1)C2(CCC2)C#N 15495
c1ccc2c(c1)C(=O)OC2=O 15496
c1ccc2c(c1)C(=O)OC2=O 22088
c1ccc2c(c1)C(=O)OC2=O 42332
CCCCCCCCCC=O 15497
C[C@]12CC[C@H]3[C@H]([C@@H]1CCC2=O)CC=C4[C@@]3(CC[C@@H](C4)O)C 15498
c1nc(c2c(n1)n(cn2)[C@H]3C[C@@H]([C@H](O3)CO)O)N 15499
C1CC[C@H]([C@@H](C1)N(CC(=O)O)CC(=O)O)N(CC(=O)O)CC(=O)O.O 15500
c1c(nc(nc1N)S)N 15501
c1cc(c(nc1)N)N 15502
c1cc(c(cc1Br)N)Br 15503
C(CBr)CBr 15504
CCCCOP(=O)OCCCC 15506
c1cc(c(c(c1)Cl)CC#N)Cl 15508
C1=C(C(=O)C(=CC1=NCl)Cl)Cl 15510
C1CC1C(=O)C2CC2 15511
CCOC(=O)C(C)C(=O)OCC 15514
c1ccc(c(c1)F)F 15515
c1cc(c(c(c1)O)O)C(=O)O 15517
c1ccc(cc1)C(=O)c2ccc(cc2O)O 15518
c1c2cc(cc(c2c(cc1S(=O)(=O)[O-])O)O)S(=O)(=O)[O-].O.O.[Na+].[Na+] 15519
c1c2cc(cc(c2c(cc1S(=O)(=O)[O-])O)O)S(=O)(=O)[O-].O.O.[Na+].[Na+] 19991
c1c2cc(cc(c2c(cc1S(=O)(=O)[O-])O)O)S(=O)(=O)[O-].O.O.[Na+].[Na+] 30060
c1c(c(nc(n1)O)O)C(=O)O 15520
CC(C)c1ccc(cc1)C(C)C 15521
COc1cc(cc(c1)OC)C=O 15522
COc1cccc(c1)OC 15523
COc1cccc(c1OC)CO 15524
COc1cccc(c1OC)O 15525
COc1ccc(cc1OC)CC#N 15526
CNC.Cl 15527
Cc1ccc(cc1C)N 15528
Cc1ccc(c(c1)CCl)C 15529
CC(=CC(=C)C)C 15536
CC(C)(CO)CO 15537
CC(C)(CO)CO 40855
c1ccc(c(c1)[N+](=O)[O-])[N+](=O)[O-] 15538
c1ccc(c(c1)c2ccccc2[N+](=O)[O-])[N+](=O)[O-] 15539
c1cc2c(cccc2[N+](=O)[O-])c(c1)[N+](=O)[O-] 15540
B(c1ccccc1)(c2ccccc2)OCCN 15542
CCCCCCCCCCCCO 15545
CCCCCCCN 15546
CC(C)CCN 15547
Cc1cccc(c1)CN 15548
CCNC/C=C/CNCC 15549
c1cc(cc(c1)F)CN 15550
CN(C)CCCN(C)C 15551
CCNCCN(C)C 15553
CCNCCN 15555
CNCCN 15556
CNCCCN 15557
CCN(CC)CCN(CC)CC 15559
CCN(CC)CCN(CC)CC 29342
CN(C)CCCCN(C)C 15560
CCNCCN(CC)CC 13962
CNCCN(C)C 15562
CNCCN(C)C 36691
Cc1ccccc1CN 15563
C(CN)CNCCN 15564
CN(C)CCNCc1ccccc1 15565
CCC1=C(C(CCC1=O)C(=O)OCC)C 15568
CCN(CC)[Si](C)(C)C 15569
C1CC2CC1CC2CC(=O)O 15570
CCCCCC(C#C)O 15572
C(N)S(=O)(=O)O 15574
Cn1c2c(c(=O)n(c1=O)C)n(cn2)CCCl 15575
Cc1ccncn1 15577
c1nc(c2c(n1)n(c(n2)Br)[C@H]3[C@@H]([C@@H]([C@H](O3)CO)O)O)N 15578
C=CC1CO1 15579
C(CNCCO)N 40071
CCC(=O)CC 15581
C1CCC(CC1)CCCC(=O)O 15582
c1cc(cc(c1)[N+](=O)[O-])C(=O)Cl 15584
c1cc(cc(c1)N)C(=O)O 15585
CCNCC.Cl 15589
c1ccc2c(c1)cccc2C(=O)N 15590
Cc1ccc(cc1)CO 15592
c1ccc(cc1)c2c(nc([nH]2)S)c3ccccc3 15596
c1(nnc(s1)S)N 15597
c1ccc(cc1)N2CCC(=O)N2 15598
C(CCBr)CCBr 15599
CCOCCO 15602
CCOc1cc(ccc1O)C=O 15603
CCOc1ccc(cc1)CC(=O)O 15604
CCOC(=O)C1C(C1(C)C)C=C(C)C 15606
CCN1C(=O)C=CC1=O 15610
CCN(CCO)c1cccc(c1)C 15612
c1ccc-2c(c1)Cc3c2cccc3 15613
C(C(=O)N)F 15614
c1cc(ccc1C=O)F 15615
c1cc(ccc1C(=O)O)F 15616
c1cc(cc(c1)F)[N+](=O)[O-] 15617
c1cc(ccc1N=C=S)F 15618
CCC(=O)c1ccc(cc1)F 15619
CCOC(=O)/C=C/C(=O)O 15620
C(CC(=O)O)[C@@H](C(=O)O)N 15621
C(=O)C=O 15622
Cc1c2c(ccn1)c3ccc(cc3[nH]2)OC.Cl 15623
CCCCCCCCCCCCCCCCC 15624
CC(CC(C)(C)C)CC(C)(C)CC(C)(C)C 15625
CCCCCCCC#N 15626
C=CCCC=C 15627
C=CCCC=C 23215
C1(=O)C(=O)C(=O)C(=O)C(=O)C1=O.O.O.O.O.O.O.O.O 15628
CCCCC(C)O 15629
c1ccc2c(c1)CC(=O)OC2=O 15630
Cc1cc(c(cc1C)O)C(=O)C 15631
CC(=C)C(=O)OCCO 15633
c1ccnc(c1)CCO 15634
COc1cc(ccc1O)/C=C/C(=O)O 15636
Cc1cc(=O)oc2c1ccc(c2)O 15638
Cc1cc(=O)oc2c1ccc(c2)O 40549
Cc1cccc(n1)O 15639
c1cc(ncc1C(=O)O)O 15640
c1c(cc(c(c1C(=O)O)O)[N+](=O)[O-])[N+](=O)[O-] 15644
C/C(=N\[Si](C)(C)C)/O[Si](C)(C)C 15646
c1ccc(cc1)CN(Cc2ccccc2)Cc3ccccc3 15647
c1ccc(cc1)CCN 15649
c1ccc(cc1)CCN 22066
C[N+](C)(C)Cc1ccccc1.C[O-] 15650
c1ccc2c(c1)C(OS2(=O)=O)Cl 15653
CCOC(=O)CCCCBr 15654
C/C=C/CC=C 15655
COc1ccc(cc1)C(c2ccccc2)(c3ccccc3)Cl 15656
CC(C)C(C)(C)O 15658
CC(=C(C)C)C 15659
CCC(C)C(=O)C(C)CC 15660
c1cc(ccc1N)I 15661
c1cc(ccc1N)I 37854
CCC1CCC(=O)CC1 15662
CC(=C)CCO 15663
c1ccc2c(c1)c(c[nH]2)C=O 15664
c1ccc2c(c1)c(c[nH]2)CC#N 15665
CC(=O)Oc1c[nH]c2c1cccc2 15666
COc1cc(cc(c1O)I)C=O 15667
CC(C)c1ccccc1O 15668
CC(C)CC(=O)O 15669
c1ccc2c(c1)[nH]c(=O)n2C3CCNCC3 15670
C1=CC(=O)NC1=O 15671
C(C(=O)N)C(=O)N 15672
CCOC(CC(OCC)OCC)OCC 15673
c1cnc(nc1)S 15674
COc1cccc(c1)C=O 15676
Cc1nc2ccc(cc2s1)OC 15677
CN.Cl 15678
CN.Cl 22067
C/C(=C\C(=O)OC)/N 15679
CNc1ccc(cc1)O.CNc1ccc(cc1)O.OS(=O)(=O)O 15680
CC(C)(C#C)O 15682
CC1=CCCCC1 15684
CC1=CCC2C1C3CC2C=C3C 15685
COC(=O)c1ccco1 15687
Cn1c2ccccc2c(=O)oc1=O 15688
COS(=O)(=O)C 15689
CN1CCNCC1 15691
CN1CCC(=O)CC1 15692
Cn1cccc1C=O 15693
CNC(=S)NN 15694
C[P+](c1ccccc1)(c2ccccc2)c3ccccc3.[Br-] 15695
CCCCCCCCCCCCCC(=O)O 15696
CCCCCCCCCCCCCC(=O)O 16729
c1ccc2cc(ccc2c1)O 15697
c1ccc2cc(ccc2c1)O 18082
c1ccc2cc(ccc2c1)O 42297
c1cc(ccc1C=O)[N+](=O)[O-] 15699
c1cc(cc(c1)[N+](=O)[O-])/C=C/C(=O)O 15701
CC[N+](=O)[O-] 15702
c1cc2cnccc2c(c1)[N+](=O)[O-] 15704
c1cc(ccc1[N+](=O)[O-])O 15705
c1ccc(c(c1)CC(=O)O)[N+](=O)[O-] 15706
CC(C)[N+](=O)[O-] 15707
c1cc2cccnc2c(c1)[N+](=O)[O-] 15708
Cc1cccc(c1C)[N+](=O)[O-] 15709
C1C2CC3CC1CC(C2)(C3)O 15710
CC(C)C(=O)c1ccccc1 15711
C(C(Cl)(Cl)Cl)(F)(F)Cl 15714
Cc1cc(ccc1N=Nc2ccccc2)N(C)C 15715
c1cc(oc1)C(=O)NN 15716
CCOC(=O)CC(=O)c1ccccc1 37085
c1cc(sc1)/C=C/C(=O)O 15723
CCCCOCCOP(=O)(OCCOCCCC)OCCOCCCC 15724
COc1cc(cc(c1O)Br)C=O 15725
C(CC#N)CC#N 15726
C1CC(=O)N(C1=O)O 15727
c1cc(ccc1CC(C(=O)O)N)Cl 15728
c1c[nH]c(=O)[nH]c1=O 15730
c1ccc2c(c1)cc(c(c2N=Nc3c4ccccc4c(cc3O)S(=O)(=O)O)O)C(=O)O 15731
C#CCCO 15733
C#CC1(CCCC1)O 15734
c1ccc(c(c1)O)Br 15736
c1ccc(cc1)C(C(=O)Cl)Cl 37060
C(=C/C#N)\C#N 15740
c1cc2c(cc1S(=O)(=O)[O-])C(=O)/C(=C\3/C(=O)c4cc(ccc4N3)S(=O)(=O)[O-])/N2.[Na+].[Na+] 15744
c1cc2c(cc1S(=O)(=O)[O-])C(=O)/C(=C\3/C(=O)c4cc(ccc4N3)S(=O)(=O)[O-])/N2.[Na+].[Na+] 41230
CCCCCCCCCO 15747
CCCCCCCCS 15748
CCCCCCCCC#N 15749
C(=O)(C(=O)NN)NN 15751
c1cc2ccc3cccnc3c2nc1 15753
c1ccc(cc1)CCN2CCC(=O)CC2 15754
c1ccc(c(c1)CC(=O)O)CC(=O)O 15755
c1ccc(cc1)OC(=O)c2cc3ccccc3cc2O 15756
C[C@@H]([C@@H](c1ccccc1)O)N.Cl 15757
c1ccc(cc1)n2cccc2 15759
Cc1ccncc1 15760
Cc1ccncc1 21950
C1CCNC(C1)CCO 15761
C1C[C@H](NC1)C(=O)O 15762
CCC[P+](c1ccccc1)(c2ccccc2)c3ccccc3.[Br-] 15763
c1cnc(cn1)C(=O)N 15764
c1cnccc1/C=N\O 15766
C[n+]1ccccc1/C=N/O.[Cl-] 15767
c1cc[n+](cc1)[O-] 15769
c1cncnc1 15770
c1cc[nH]c1 15771
c1ccc(cc1)NC(=O)c2ccccc2O 15773
CNCC(=O)O 15774
c1cc(c(c(c1Cl)Cl)Cl)Cl 15777
c1c(c(cc(c1Cl)Cl)Cl)Cl 15778
c12c(c(c(c(c1Cl)Cl)Cl)Cl)C(=O)OC2=O 15779
CCOC(=O)C(C(C(=O)OCC)C(=O)OCC)C(=O)OCC 15780
CCO[Si](OCC)(OCC)OCC 15781
CCO[Si](OCC)(OCC)OCC 21691
C1CC(OC1)CN 15782
CC1(C(C(C1O)(C)C)O)C 15783
C1CSCCO1 15784
Cc1cnc(nc1O)O 15785
Cc1ccc(cc1)S(=O)(=O)NN 15786
Cc1cccc(c1)N 15787
Cc1ccc(cc1)CCN 15788
c1cc(c(cc1Cl)Cl)Cl 15790
c1cc(c(cc1Cl)Cl)Cl 22020
CCN(CC)CC 15791
CCN(CC)CC 21951
C(=O)(C(F)(F)F)[O-].[Na+] 15793
COc1cc(c(cc1OC)OC)C=O 15794
COc1cc(cc(c1OC)OC)C#N 15795
Cc1cc(c(c(c1)C)N)C 15796
COP(=O)(OC)OC 15797
COP(=O)(OC)OC 22068
c1ccc2c(c1)c(c[nH]2)CCN.Cl 15798
C=CCCCCCCCCC=O 15799
C=CCCCCCCCCC=O 38820
C=Cc1ccccn1 15800
Cc1cccc(c1)C#N 15801
Cc1ccc(cc1)C#N 15802
c1cc(ccc1Cc2ccc(cc2)N)N 15804
COc1ccc(cc1)C#N 15805
c1cnc(cn1)Cl 15806
CC[C@H](CO)N 15807
CC[C@H](CO)N 24403
CC[C@@H](CO)N 15808
c1ccc(cc1)OCCCCBr 15809
C1CCC(C(C1)N)N 15810
COc1cc(cc(c1)OC)O 15812
CCC/C=C/C=O 15813
CCC/C=C/CO 15814
C(CCl)C(=O)O 15815
c1cc(ccc1C(=O)CCl)F 15817
CC(=O)Oc1ccccc1C(=O)O 15818
c1ccc(cc1)N 15819
c1ccc(cc1)N 22173
c1ccc(cc1)N 42342
C(Br)(Br)Br 15820
C(Br)(Br)Br 22069
C(Br)(Br)Br 40301
C(Cl)(Cl)Cl 15821
C(Cl)(Cl)Cl 16773
C(Cl)(Cl)Cl 23209
C(Cl)(Cl)Cl 26832
C(Cl)(Cl)Cl 32667
C(Cl)(Cl)Cl 32682
C(Cl)(Cl)Cl 36432
C(Cl)(Cl)Cl 40463
C(Cl)(Cl)Cl 42355
C(Cl)(Cl)Cl 61003
C(Cl)(Cl)Cl 61028
C(Cl)(Cl)Cl 38376
C(Cl)(Cl)Cl 38377
C(Cl)(Cl)Cl 39076
C/C=C/C=O 15822
CCCCNCC 15823
CC(C)(c1ccc(cc1)O)c2ccc(cc2)O 15824
CNCCO 15826
CNCCO 21954
CCC(C)CO 15827
CC(C)CO 15828
CC(C)CO 16770
CC(C)CO 29571
CC(C)CO 41265
CC(C)CO 41266
CCCOC(=O)C 15829
c1ccc(c(c1)C(=O)[O-])O.[Na+] 15830
c1ccc(c(c1)C(=O)[O-])O.[Na+] 22098
C(=C(Cl)Cl)Cl 15831
C(=C(Cl)Cl)Cl 42152
c1ccc(cc1)c2ccnc3c2ccc4c3nccc4c5ccccc5 15832
C1C(=N)N=C(S1)N.Cl 15834
c1cc[nH+]cc1.Br[Br-]Br 15836
Cc1nnc(s1)N 15837
CCCC[N+]#[C-] 15838
[C-]#[N+]C1CCCCC1 15840
c1ccc(cc1)N.Cl 15841
c1ccc(cc1)NC=O 15842
CC(=O)Nc1ccc(cc1)C(=O)O 15843
c1ccc2cc(ccc2c1)S(=O)(=O)Cl 15844
C(CCCCCCBr)CCCCCBr 15845
C(C(Cl)(Cl)Br)(Cl)(Cl)Br 15846
c1cc2c(c(c1)Cl)nc(s2)N 15847
Cc1c(nnc(n1)N)C 15849
c1ccc2c(c1)ccc(c2N)O.Cl 15850
c1ccc2c(c1)c(ccc2O)N.Cl 15851
c1c(sc(n1)N)[N+](=O)[O-] 15852
CC(=O)CC(=O)Nc1ccc(cc1)Cl 15855
c1cc(ccc1S(=O)(=O)Cl)Cl 15856
c1ccc(cc1)/C=C/C(=O)O 15857
CCOC(=O)CBr 15859
CC(=O)OC[C@@H]1[C@@H]([C@@H]([C@H]([C@@H](O1)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C 15861
c1ccc(c(c1)C(=O)NCC(=O)O)O 15862
COCC1CCCO1 15866
Cc1ccc2c(c1)c(c[nH]2)CCN.Cl 15867
C1COCCN1 15868
C1COCCN1 41516
c1ccc(cc1)c2ccc(cc2)O 15871
CC(CO)O 15872
CC(CO)O 22087
C(CC(=O)O)C(=O)N 15873
C(CC(=O)O)C(=O)O 15874
C(CC(=O)O)C(=O)O 21955
C(CC(=O)[O-])C(=O)[O-].O.O.O.O.O.O.[Na+].[Na+] 15875
C1CC(=O)OC1=O 15876
Cc1ccc(cc1)C 15877
Cc1ccc(cc1)C 22021
Cc1ccc(cc1)C 42267
CCCCCCCCCCCCCCCCCCCCCC 15878
CC[N+](CC)(CC)CC.Cc1ccc(cc1)S(=O)(=O)[O-] 15879
CC(C)(C)OC(=O)NCC(=O)O 15880
C(C(CO)([N+](=O)[O-])Br)O 15882
C=CCC(=O)O 15883
c1ccc(cc1)NNC(=O)NNc2ccccc2 15884
CCN(CC)c1ccc(cc1)N=O 15885
c1ccc(cc1)C2=CCNCC2.Cl 15886
CC(=O)c1ccc2ccccc2c1 15888
CCCCCCCCCCCCCCCCCCCCCCCCCCCCCC(=O)O 15889
[H]([OH]C)[O+]([B-](F)(F)F)C 15890
c1ccc(cc1)C(c2ccccc2)(c3ccccc3)O 15891
C(C(CO)O)O 15892
C(C(CO)O)O 18469
C(C(CO)O)O 27736
C(C(CO)O)O 29560
C(C(CO)O)O 32725
C(C(CO)O)O 33203
C(C(CO)O)O 41098
C[C@@H]([C@@H](c1ccccc1)O)NC 15894
c1ccc2c(c1)[C@]34CCN5[C@H]3C[C@@H]6[C@@H]7[C@@H]4N2C(=O)C[C@@H]7OCC=C6C5 15895
CC(C)OC(C)C 15896
CC(C)OC(C)C 18068
CC(C)OC(C)C 39066
c1cc(cc(c1)I)CN.Cl 15897
c1ccc(c(c1)O)O 15898
CC(C)(C)C(=O)Oc1ccc(cc1)[N+](=O)[O-] 15900
CC(=O)n1cc(c2c1ccc(c2)Br)OC(=O)C 15901
c1ccc(cc1)S(=O)(=O)O 15902
c1ccc(cc1)P(=S)(c2ccccc2)c3ccccc3 15903
CCOC(=O)P(=O)(OCC)OCC 15904
c1cc(ccc1C(=O)CCCl)F 15906
CCC(C)NC(C)CC 15907
C1CCC(CC1)Br 15908
CC(C(=O)O)N 15909
c1ccc(cc1)CCC(=O)O 15910
C[C@H](CCC(=O)O)[C@H]1CC[C@@H]2[C@@]1([C@H](C[C@H]3[C@H]2[C@@H](C[C@H]4[C@@]3(CC[C@H](C4)O)C)O)O)C 15911
c1ccc(cc1)[P+](CCCBr)(c2ccccc2)c3ccccc3.[Br-] 15912
C(Cl)Br 15913
C(C(Br)Br)(Br)Br 15914
C(C(Br)Br)(Br)Br 18087
C[N+](C)(C)c1ccccc1.[Br-] 15916
CC(=O)OCC[N+](C)(C)C.[Cl-] 15917
CCOC(=O)C(=O)OCC 15918
CC(=O)Cc1ccccc1 15919
c1cc(c(cc1C[C@@H](C(=O)O)N)N)O.O.Cl.Cl 15920
CCOC(=O)C(Cc1ccccc1)C(=O)OCC 15922
c12c(c(c(c(c1Cl)Cl)Cl)Cl)C(=O)NC2=O 15923
c1ccc(c(c1)C(=O)O)Cl 15924
c1cc(ccc1C(=O)O)Cl 15925
CC(C)(C)Br 15926
COC(=O)C(=O)OC 15927
c1ccc2c(c1)C(=O)C(C2(O)O)(C3(C(=O)c4ccccc4C3(O)O)O)O 15928
C1C(OC(=O)N1)CCl 15929
c1ccc2c(c1)c3ccccc3o2 15930
c1ccc2c(c1)c3ccccc3o2 21703
CC(C)c1cc(c(c(c1)C(=O)O)O)C(C)C 15931
c1cc(c(cc1[N+](=O)[O-])C#N)Cl 15932
c1ccc(cc1)C(=O)N 15933
c1c(cnc(c1Cl)N)Cl 15938
c1cc(ncc1Cl)O 15939
CC(=O)Br 15940
CCCCCN 15941
CCCCCN 17394
c1cc2cnccc2c(c1)N 15942
c1ccc(cc1)/C=C/C(=O)c2ccccc2 15943
Cc1nccn1C 15944
c1ccc(c(c1)[N+](=O)[O-])I 15945
c1ccc(cc1)C(=O)c2ccc(cc2)N3CCOCC3 15946
Cc1[nH]c(cn1)[N+](=O)[O-] 15947
c1ccc(cc1)C(CCN)c2ccccc2 15948
C1C(=O)NC(=O)S1 15949
COC(=O)CC(=O)OC 15956
COC(=O)CC(=O)OC 22070
CC(=O)c1ccc(cc1)N2CCNCC2 15957
c1ccc2cc(c(cc2c1)N)N 15959
C1CC(=O)N(C1)CCCN 15960
C1CC2=NCCCN2C1 15961
CC1=C(C2(C1(C(=C2C)C)C)C)C 15963
c1cc(cc(c1)Cl)CBr 15964
CC(C)(C=C)O 15967
CC(C(C)(C)C)O 15968
CC(C)C(=O)C(C)C 15970
CC(=O)CC(C)(C)C 15971
C1C=CC[C@H]2[C@@H]1C(=O)OC2=O 15972
COc1ccc(cc1)CO 15973
CCCCCC(=O)CC 15974
CN(C)Cc1ccccc1 15975
CN(C)Cc1ccccc1 18088
CCCCC(=O)CCCC 15976
CC(C)NCc1ccccc1 15977
Cc1cc(c(c(c1)C)CCl)C 15978
CCCCCC(=O)CCCCC 15979
CCOC(=O)c1ccccc1.CCOC(=O)C1=C(NC(=C(C1C)C(=O)OCC)C)C 15981
CCOC(=O)c1ccccc1.CCOC(=O)C1=C(NC(=C(C1C)C(=O)OCC)C)C 42240
*O[C@H]1[C@H]([C@H](O[C@H]([C@@H]1O)O[C@@H]2[C@@H]3CO[C@H]2[C@@H]([C@@H](O3)O*)O)CO)O 15982
*O[C@H]1[C@H]([C@H](O[C@H]([C@@H]1O)O[C@@H]2[C@@H]3CO[C@H]2[C@@H]([C@@H](O3)O*)O)CO)O 18442
*O[C@H]1[C@H]([C@H](O[C@H]([C@@H]1O)O[C@@H]2[C@@H]3CO[C@H]2[C@@H]([C@@H](O3)O*)O)CO)O 18644
*O[C@H]1[C@H]([C@H](O[C@H]([C@@H]1O)O[C@@H]2[C@@H]3CO[C@H]2[C@@H]([C@@H](O3)O*)O)CO)O 23901
*O[C@H]1[C@H]([C@H](O[C@H]([C@@H]1O)O[C@@H]2[C@@H]3CO[C@H]2[C@@H]([C@@H](O3)O*)O)CO)O 23902
*O[C@H]1[C@H]([C@H](O[C@H]([C@@H]1O)O[C@@H]2[C@@H]3CO[C@H]2[C@@H]([C@@H](O3)O*)O)CO)O 40041
*O[C@H]1[C@H]([C@H](O[C@H]([C@@H]1O)O[C@@H]2[C@@H]3CO[C@H]2[C@@H]([C@@H](O3)O*)O)CO)O 40042
CCOCC(=O)O 15986
Cc1ccc(cc1C)C(=O)C 15989
c1cc(c(cc1Br)C=O)O 15991
c1cc(c(cc1Br)C=O)O 29076
Cc1ccc(o1)C=O 15992
c1cc(cc(c1)S(=O)(=O)F)N.Cl 15993
CC1=NCCO1 15997
CCC1=NCCO1 15998
Cc1cccc(c1C)OC 15999
Cc1ccc(c(c1)C)OC 16000
Cc1ccc(c(c1)OC)C 16001
Cc1ccc(cc1C)OC 16002
C(CBr)S(=O)(=O)[O-].[Na+] 16003
C(CBr)S(=O)(=O)[O-].[Na+] 40296
CCN(CC)C(=O)C 16004
CCC(C)(C#C)O 16006
c1c(c(cc2c1OCO2)[N+](=O)[O-])C=O 16007
c1ccc(c(c1)C(=O)O)Br 16008
c1c(cc(c(c1Br)O)Br)Br 16010
c1c(cc(c(c1I)O)I)I 16011
CC(C)(C)c1ccc(c(c1)C(C)(C)C)O 16012
Cc1ccc(cc1C)Cl 16013
Cc1ccc(c(c1)O)[N+](=O)[O-] 16015
c1cc(c(c(c1)[N+](=O)[O-])C(=O)O)C(=O)O 16016
Cc1c(cccc1[N+](=O)[O-])C(=O)O 16017
Cc1cc(cc(c1)[N+](=O)[O-])C 16018
Cc1cc(cc(c1)N)C 16019
Cc1ccc(c(c1)C(=O)O)N 16020
COc1cccc(c1OC)OC 16021
c1(c(c(nc(c1Cl)Cl)Cl)Cl)Cl 16022
Cc1cc(nc(n1)S)C 16023
c1cc(oc1)C(=O)C(=O)c2ccco2 16024
c1ccc(cc1)C(=O)OC(C(C(=O)O)OC(=O)c2ccccc2)C(=O)O.O 16025
c1cc(ccc1C[C@@H](C(=O)NN)N)O 16026
C1C2CC3CC1CC(C2)(C3)C#N 16027
CC(=O)N[C@@H](CS)C(=O)O 16028
CCOC(=O)c1cc2cc(ccc2[nH]1)Cl 16029
COc1cc(ccc1O)C(=O)OC 16030
Cc1ccc(c(c1)C)C(=O)O 16032
Cc1ccc(c(c1)C(=O)O)C 16033
c1cc(ccc1S(=O)(=O)C(C(F)Cl)(F)F)Cl 16037
COc1ccco1 16038
c1cc(cc(c1)Br)[N+](=O)[O-] 16039
c1cc(c(cc1CC(C(=O)O)N)F)O 16041
CCC(CC)(C(=O)O)O 16043
C([C@@H]1[C@@H]([C@@H]([C@H](C(O1)O)N)O)O)O.Cl 16044
Cc1cccc(c1)Cl 16045
c1cc(cc(c1)I)C(=O)O 16048
c1cc(cc(c1)I)C(=O)O 39300
C1[C@H]([C@H]([C@@H](C[C@@]1(C(=O)O)O)O)O)O 16050
c1cc(c(cc1[N+](=O)[O-])[N+](=O)[O-])Cl 16051
c1cc(ccc1CC(=O)O)Br 16052
COc1cc(c(c(c1)OC)C=O)OC 16053
COc1cc(cc(c1)OC)OC 16055
COc1cc(c(cc1OC)OC)C(=O)O 16056
C\1=C\C=C/C=C\C=C1 16057
CCCCCO 16060
C1CCC2=NCCCN2CC1 16061
c1cc(c(cc1[N+](=O)[O-])C=O)Cl 16063
c1cc(c(cc1[N+](=O)[O-])C=O)Cl 40487
CC1(C2CCC1(C(C2)O)C)C 16065
CC(C)C(=O)Cl 16066
CC(C(=O)OC)Cl 16067
C[N+](C)(C)c1ccccc1.[I-] 16068
c1ccc2c(c1)c(c[nH]2)CCCC(=O)O 16069
C(Cl)(Cl)Br 16070
c1ccc(cc1)C(=O)C2CCCCC2 16071
c1cc(ccc1CC(=O)O)Cl 16072
CCOC(=O)/C=C/c1ccc(cc1)[N+](=O)[O-] 16074
CC(=O)c1cccc(c1)N 16077
CCCCCC 16078
CCCCCC 19736
CCCCCC 32666
CCCCCC 32671
CCCCCC 32678
CCCCCC 32692
CCCCCC 32789
CCCCCC 36437
CCCCCC 38380
c1c(cc(cc1Cl)Cl)C#N 16079
c1c(cc(cc1Cl)Cl)C=O 16080
c1cc(ccc1C#N)F 16081
c1(nnc(s1)[S-])[S-].[K+].[K+] 16082
CCOC(=O)C(C)(C(=O)OCC)Br 16083
C/C=C/C(=O)OC 16084
CN1CCCC1CCO 16087
C1C(O1)CCCCC2CO2 16089
c1cc(c(cc1Cl)Cl)C(=O)O 16090
C1C2CC3CC1CC(C2)(C3)N.OS(=O)(=O)O 16091
C1C2CC3CC1CC(C2)(C3)N.C1C2CC3CC1CC(C2)(C3)N.C(=C/C(=O)O)\C(=O)O 16092
COC(=N)C(Cl)(Cl)Cl 16093
C[N+](C)(C)c1ccccc1.Br[Br-]Br 16094
c1ccc(cc1)C(=O)Br 16095
CC1CCCC(C1)O 16096
c1ccc(cc1)N=C=S 16097
c1ccc(cc1)N=C=S 41762
CCCCCCCCCCCCOc1ccc(cc1)C(=O)O 16098
Cc1ccc(cc1[N+](=O)[O-])O 16099
Cc1ccc(cc1[N+](=O)[O-])OC 16100
c1ccc(cc1)/C=C/c2ccccc2 16104
c1ccc(cc1)/C=C/c2ccccc2 41972
C(C(C(=O)O)Br)Br 16105
COc1cccc(c1)O 16106
CC[N+](CC)(CC)CC.[Br-] 16107
CC[N+](CC)(CC)CC.[Br-] 22071
c1c(cc(cc1Br)Br)Br 16108
c1cc(ccc1CCl)[N+](=O)[O-] 16109
C1C2CC3CC1CC(C2)(C3)NC(=O)N 16110
COc1ccccc1OC 16111
c1(c(c(c(c(c1Cl)Cl)Cl)Cl)Cl)O 16112
c1ccc(cc1)C2(CCCC2)C(=O)O 16114
CC(C)(C)COC(N(C)C)OCC(C)(C)C 16115
c1(nc([nH]n1)S)N 16116
CCCCCCCCCC(=O)Cl 16119
c1cc2c(ccc(c2nc1)O)[N+](=O)[O-] 16120
CC(C)(C)c1cc(cc(c1O)C(C)(C)C)C=O 16121
CN(C)C(OC)OC 16125
CCCC[N+](CCCC)(CCCC)CCCC.[I-] 16127
C(CCBr)CBr 16128
C(CCBr)CBr 33774
c1ccc(cc1)CCCO 16131
c1ccc(c(c1)[N+](=O)[O-])SCl 16133
Cc1cc(c2ccc3c(cc(nc3c2n1)C)c4ccccc4)c5ccccc5 16134
C1[C@H]([C@H]([C@@H](C(O1)(CO)O)O)O)O 16135
C1[C@H]([C@H]([C@@H](C(O1)(CO)O)O)O)O 21957
CC(CBr)Br 16137
CCOC(=O)/C=C/C 16138
COc1ccc(cc1)C=C 16139
c1ccc(c(c1)C#N)O 16141
C1[C@H]([C@H]([C@@H](C(O1)O)O)O)O 16145
CC(C)(C)C(=O)OCCl 16146
c1cc(ccc1N=Nc2ccc(c(c2)S(=O)(=O)[O-])N=Nc3c4ccc(cc4cc(c3O)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+] 16147
CC(=O)Cc1ccc(c(c1)OC)OC 16149
Cc1c(cccc1Cl)F 16150
c1cc(c(c(c1)Cl)C=O)F 16151
c1cc(ccc1C(=O)CCCl)Br 37558
c1cc(ccc1C2(CCCC2)C(=O)O)Cl 16157
c1cc(ccc1C(=O)CCCl)Cl 16159
c1c(nc[nH]1)[N+](=O)[O-] 16160
C1CCN(CC1)CCN 16161
CCCN1CCNCC1.Br.Br 16162
c1cc(sc1)CC#N 16163
c1(c(nc([nH]1)Br)Br)Br 16164
C1CC[C@H]([C@@H](C1)O)O 16165
c1cc(c(c(c1)Cl)C(=O)N)Cl 16169
CN1C2CCC1CC(C2)OC(=O)C(c3ccccc3)O.Br 16170
CC[C@H]1[C@H](COC1=O)Cc2cncn2C.Cl 16172
C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)O[C@H]2C[C@H]([C@@]3([C@@H]4[C@@H](CC[C@@]3(C2)O)[C@]5(CC[C@@H]([C@]5(C[C@H]4O)C)C6=CC(=O)OC6)O)CO)O)O)O)O.O.O.O.O.O.O.O.O 16173
COc1ccc(cc1)C(=O)c2ccc(cc2)OC 16174
CN1C2CC(CC1C3C2O3)OC(=O)[C@H](CO)c4ccccc4.O.O.O.Br 16175
c1c[nH]c(=O)nc1N 16176
C(C(Cl)(Cl)Cl)OC(=O)Cl 16181
CCOC(=O)N(Cl)Cl 16182
CCN(CC)Cc1cc(ccc1O)N.Cl.Cl 16190
CCCCOc1ccccc1 16192
c1ccc(cc1)CC2CCNCC2 16193
c1ccc(cc1)C(=O)C=O.O 16197
CCCCC(CC)(CO)CO 16198
C(CBr)C(=O)Cl 16199
c1ccc(cc1)Cc2ccccc2O 16200
C(CN)CCl.Cl 16201
C(=NS(=O)(=O)Cl)=O 16204
C1CCN(C1)C(=S)[S-].[NH4+] 16205
C1CCN(C1)C(=S)[S-].[NH4+] 41864
c1ccc(cc1)C(=O)Oc2ccccc2 16206
CC1(CCCCC1)C(=O)O 16211
C(C(=O)O)(F)F 16212
c1cc(nc(c1)C(=O)Cl)C(=O)Cl 16213
c1cc(c(cc1Br)C(=O)O)O 16214
c1cc(c(cc1S(=O)(=O)F)N)Cl 38264
c1cc(c(cc1S(=O)(=O)F)C(=O)O)Cl 16219
c1ccc(cc1)c2nc(sn2)N 16221
CCOC(=O)c1c(nc(s1)N)c2ccccc2 16222
c1ccnc(c1)SSc2ccccn2 16223
c1cnccc1SSc2ccncc2 16224
CN(C)CC#C 16225
C(C(=O)O)OCC(=O)O 16226
CCOC(=O)C1CCN(CC1=O)Cc2ccccc2.Cl 16230
c1cc(ccc1NN)Br.Cl 16231
COc1ccc(c(n1)OC)N.Cl 16232
Cc1cc(c(cc1Cl)C(=O)c2ccccc2)O 16234
C1C2CC3CC1CC(C2)(C3)N=C=S 16236
CCCCCCCCCCCCCCCCS(=O)(=O)c1ccc(cc1)N 16238
c1ccc(cc1)c2c(oc(n2)S)c3ccccc3 16239
C(=N)(NN)NN.Cl 16240
c1cc(cc(c1)S)N 16243
CC(C)(C)C(=O)OC(=O)C(C)(C)C 16244
c1cc2c(cc1O)cc([nH]2)C(=O)O 16245
c1ccc2c(c1)c(cc(c2O)C(=O)O)S(=O)(=O)F 16247
CN(C)P(N(C)C)N(C)C 16248
CC(C)(CCC(C)(C)O)O 16250
Cc1cccc(c1)N=C=O 16251
Cc1ccc(cc1)N=C=O 16252
COc1cc(ccc1O)CC(=O)O 16253
c1ccc2c(c1)C=Cc3ccccc3N2 16254
c1ccc2cc(ccc2c1)CBr 16256
COc1ccc(cc1O)C=O 16257
COCCN 16258
COCCN 22072
C(/C(=C(/CO)\Br)/Br)O 16259
c1ccc(cc1)[Si](c2ccccc2)(c3ccccc3)O 16260
COc1ccc(cc1OC)C=O 16261
CC(=CC(C)(C)C)C 16263
c1cnc(nc1Cl)Cl 16265
CCOC(=O)C(C)(C)C(=O)OCC 16266
CCC(=O)N 16267
c1cc(c(c(c1)Cl)/C=C/C(=O)O)Cl 16268
CCCN(CCC)CCC 16269
CCCN(CCC)CCC 21958
C1CCOC(=O)C1 16271
Cc1ccc2c(c1)ccc(n2)C 16272
CCOC(=O)CCCCCCCCCCCCC(=O)OCC 16274
c1cc(ccc1CBr)C#N 16276
c1cc(ccc1C=O)O 16277
COc1ccc(cc1)/C=C/C#N 16281
Cc1cc(nc(n1)Cl)Cl 16282
CSc1nc(c(c(n1)Cl)c2ccccc2)Cl 16283
C[SiH](C)Cl 16284
c1cc(c(cc1C=O)[N+](=O)[O-])O 16289
Cc1nc(cs1)c2ccc(cc2)c3ccccc3 16291
Cc1ccc2c(c1)[n+](c(o2)C)CCC(=O)O.[Br-] 16292
Cc1ccc(c(n1)CO)O 16293
CC(C)C(=O)N 16294
CN(C)C=C(C#N)C#N 16295
Cc1c(nc2ccccc2n1)O 16297
c1ccc(cc1)COc2cccnc2N 16298
c1cc(cc(c1)I)[N+](=O)[O-] 16299
c1ccc(cc1)Nc2ccccc2C(=O)O 16300
c1ccc2c(c1)con2 16301
CSc1nc(cc(n1)Cl)Cl 16303
c1cc(c(cc1Cl)Cl)/C=C/C(=O)O 37229
c1cc(cc(c1)O)/C=C(\C#N)/C(=O)O 16309
C(=O)(C(F)(F)F)N 38522
c1ccc(c(c1)CBr)C#N 16313
c1ccc(cc1)c2c[nH]cn2 16314
C1CC(C(CCC(C(CCC(C1Br)Br)Br)Br)Br)Br 16315
C(N(CP(=O)(O)O)CP(=O)(O)O)P(=O)(O)O 16317
C1(C(C(OC1C(=O)O)C(=O)O)C(=O)O)C(=O)O 16318
CSc1cccc(c1)N 16319
Cc1cc(ccc1N)O 16320
Cc1ccc(c(c1)N)O 16321
Cc1ccc(c(c1)O)N 16322
c1cc(c(cc1C(=O)O)Cl)Cl 37421
c1cc(c(cc1Cl)C(=O)O)Cl 16324
CCOc1ccc(cc1)C(=O)O 16325
Cc1ccc(cc1Cl)Cl 16328
c1cc2c(ccc(c2N)[N+](=O)[O-])nc1 16330
CC1CN2CCOC2(O1)C 16331
c1ccc2c(c1)cc(cc2O)O 16334
COc1ccc(cc1OC)/C=C/C#N 16336
c1c(ncnc1Cl)Cl 16337
c1c(cc(c(c1I)O)I)[N+](=O)[O-] 16339
CC(=O)OCc1ccc(o1)C=O 16340
c1ccc(c(c1)CO)Cl 16342
c1cc(ccc1/C=C(\C#N)/C(=O)O)O 16344
CN(C)c1ccc(cc1)/C=C/C#N 16348
COc1cc2c(cc1OC)N3C4[C@]25CCN6[C@H]5C[C@@H]7[C@H]4[C@H](CC3=O)OCC=C7C6.O.O 16350
c1cc(cc(c1)C#N)CBr 16351
c1c(cc(c(c1Cl)N)Cl)Cl 16356
c1cc(ccc1CC(C(=O)O)N)O 16357
CC(c1ccc(cc1)Br)O 16358
CC1=CC(=O)CC1 16359
CCCCCCCCCCBr 16360
COc1cc(ccc1C(=O)O)Cl 16361
CC(C(=O)Cl)Br 16362
c1[nH]c2c(n1)c(ncn2)N.c1[nH]c2c(n1)c(ncn2)N.OS(=O)(=O)O 16363
c1cc(cc(c1)C#N)C#N 16366
CNC 16367
CNC 40800
CNC 37026
CNC 38838
COc1ccc2c(c1)c(ccn2)[C@@H]([C@H]3CC4CCN3C[C@@H]4C=C)O 16368
COc1ccc2c(c1)c(ccn2)[C@@H]([C@H]3CC4CCN3C[C@@H]4C=C)O 33886
COc1ccc2c(c1)c(ccn2)[C@H]([C@@H]3CC4CCN3C[C@@H]4C=C)O 16370
COc1ccc2c(c1)c(ccn2)[C@H]([C@@H]3CC4CCN3C[C@@H]4C=C)O.COc1ccc2c(c1)c(ccn2)[C@H]([C@@H]3CC4CCN3C[C@@H]4C=C)O.O.O.OS(=O)(=O)O 16371
COc1ccc2c(c1)c(ccn2)[C@H]([C@@H]3CC4CCN3C[C@@H]4C=C)O.O.O.Cl 16372
c1cc(ccc1Cc2ccncc2)Cl 16373
c1cc(cc(c1)[N+](=O)[O-])CO 16378
C(CN)C(=O)O 16379
C(CN)C(=O)O 21959
C=CC(=O)NCNC(=O)C=C 16380
C=CC(=O)NCNC(=O)C=C 16479
C(CO)N(CCO)C(CO)(CO)CO 16382
C(CO)N(CCO)C(CO)(CO)CO 16887
C(CO)N(CCO)C(CO)(CO)CO 32772
c1c(cc(c(c1S(=O)(=O)Cl)O)Cl)Cl 16383
CN1CCCC(C1)CO 16384
*O[Si](*)(C)C 16385
Cc1ccc(c(c1)C(=O)O)O 16386
COc1ccc(c(c1)C(=O)O)O 16387
c1cc2c(cc1/C=C/C(=O)O)OCO2 16389
c1cc(cc(c1)C#N)C=O 16390
Cc1cc(c(cc1Cl)[N+](=O)[O-])O 16391
c1ccc(c(c1)C(Cl)(Cl)Cl)F 16392
CCN1CCCC1=O 16393
Cc1cc(ccc1N)[N+](=O)[O-] 16395
c1cc(cc2c1cc(cc2S(=O)(=O)O)S(=O)(=O)O)N 16396
CC(C)CC=O 16397
C[Sn](C)(C)C 16398
C[Sn](C)(C)Cl 16399
CSC#N 16403
c1nc(c2c(n1)n(cn2)[C@H]3[C@@H]([C@@H]([C@H](O3)CO)O)O)N 16404
CS(=O)(=O)[O-].CS(=O)(=O)[O-].c1ccc(cc1)c2ccnc3c2ccc4c3nccc4c5ccccc5.[Na+].[Na+] 16405
Cc1cc(c2ccc3c(cc(nc3c2n1)C)c4ccccc4)c5ccccc5.CS(=O)(=O)[O-].CS(=O)(=O)[O-].[Na+].[Na+] 16406
CC(C(C)O)[N+](=O)[O-] 16408
c1cc(c(cc1Cl)Cl)CO 16409
c1ccc2c(c1)CC(=O)C2 16411
Cc1ccc(cc1)C(=O)C(=O)c2ccc(cc2)C 16412
c1cc(c(cc1Cl)Cl)C=O 16414
COc1ccc(cc1)CNc2ccccn2 16415
COc1ccc(c(c1)C=O)O 16416
CCCCCCC(=O)O 16417
CC[N+](CC)(CC)Cc1ccccc1.[Br-] 16420
c1ccc2ccccc2c1 18020
c1ccc2ccccc2c1 18090
CC1(C2CCC1(C(=O)C2Br)C)C 16422
c1cc(c(cc1N)[N+](=O)[O-])O 16423
C1CCOC1 16424
C1CCOC1 17663
C1CCOC1 18150
C1CCOC1 22216
C1CCOC1 26829
C1CCOC1 32697
C1CCOC1 34845
C1CCOC1 61010
C1CCOC1 61045
C1CCOC1 61090
C1CCOC1 61091
C1CCOC1 61092
C=CC(=O)O 16425
CCCCCCC(=O)Cl 16426
Cc1ccc(cc1[N+](=O)[O-])C(C)C 16428
Cc1ccc(cc1[N+](=O)[O-])C(C)C 41593
c1ccc(cc1)C=C(C#N)C#N 16429
CC(=C(C(=O)C)C(=O)C)O 16430
c1ccc(cc1)[As+](c2ccccc2)(c3ccccc3)c4ccccc4.O.O.Cl.[Cl-] 16431
c1c(c(cc2c1OCO2)Cl)CCl 38830
CCOc1ccccc1C(=O)O 16433
C(CCCCNC(=O)C(Cl)Cl)CCCNC(=O)C(Cl)Cl 16434
C1CC[C@H]([C@@H](C1)C(=O)O)C(=O)O 16435
CC1=CCC2CC1C2(C)C 16436
CC1=CCC2CC1C2(C)C 41801
c1c(cc(cc1C(=O)Cl)C(=O)Cl)C(=O)Cl 16437
C/C/1=C\CC/C(