Molecule directory
Explore structures, source datasets and saved model predictions for molecules registered in MolClass.
Search by molecule name, identifier or structure →- 4262663
MolClass #46301
JGKAUGPLUFANPI-UHFFFAOYSA-N
- 7973028
MolClass #46302
DMKPLKFQNBYLAC-UHFFFAOYSA-N
- 7972877
MolClass #46303
DBJPVRXEDJLFDX-NTEUORMPSA-N
- 24782584
MolClass #46304
OLKPYROJCKADER-MDZDMXLPSA-N
- 4261772
MolClass #46305
ZFGLUIRRXJEQSV-UHFFFAOYSA-N
- 22403216
MolClass #46306
RTJNPMJOXUCZAE-UHFFFAOYSA-N
- 17407912
MolClass #46307
RLSWHNDIGCWNCD-UHFFFAOYSA-N
- 856645
MolClass #46308
SXBIXBCMSIGHAW-UHFFFAOYSA-N
- 14723555
MolClass #46309
SCQVYKLRVXSLTR-NVNXTCNLSA-N
- 24823365
MolClass #46310
PBKAUTSUBNRJGW-BQYQJAHWSA-N
- 3713061
MolClass #46311
DOPQIXFYZWGPJF-UHFFFAOYSA-N
- 24818300
MolClass #46312
CYHAERRXOYRCDH-UHFFFAOYSA-N
- 3711746
MolClass #46313
GRLAEESXWWNXEM-UHFFFAOYSA-N
- 24806548
MolClass #46314
SBMYEIMIYRGZDX-UHFFFAOYSA-N
- 842641
MolClass #46315
DQPVHHGDWRCRCB-UHFFFAOYSA-N
- 4242206
MolClass #46316
CVBQOUJWPVQKJI-UHFFFAOYSA-N
- 22403535
MolClass #46317
QFZNPPLSJURITG-UHFFFAOYSA-N
- 24819229
MolClass #46318
PKKJPXRCGMKZSB-UHFFFAOYSA-N
- 24833940
MolClass #46319
SGAGWVOUHURHEO-NFCCXWOGSA-N
- 24828515
MolClass #46320
DCQGGUGPHJXAOY-UHFFFAOYSA-N
- 24786170
MolClass #46321
LUIZBGHMMRKFLE-UHFFFAOYSA-N
- 24781583
MolClass #46322
- 17514445
MolClass #46323
YFOKZIALXYIBGU-UHFFFAOYSA-N
- 24785346
MolClass #46324
PWNNLCYMENITFW-UHFFFAOYSA-N
- 865954
MolClass #46325
CWFMAHVSOBKHGW-UHFFFAOYSA-N
- 17512331
MolClass #46326
- 17513373
MolClass #46327
OVTYVAITORPHKQ-XSDIEEQYSA-N
- 16953001
MolClass #46328
GPASAOIPUJJXRX-UHFFFAOYSA-N
- 3712823
MolClass #46329
MCYFPKOKVIGZCE-UHFFFAOYSA-N
- 24828523
MolClass #46330
YSDKLJLQBNLZIB-UHFFFAOYSA-O
- 864994
MolClass #46331
KWEFYHLMQCAPSI-QAETUUGQSA-N
- 17388087
MolClass #46332
DKLBAZQPAMVQEU-UHFFFAOYSA-N
- 17407408
MolClass #46333
CTRKQUBNIIMGIZ-UHFFFAOYSA-N
- 849209
MolClass #46334
BMBQXCMFLGSXOJ-KAMYIIQDSA-N
- 24782053
MolClass #46335
GLQPPWCSQFOGQM-AUEPDCJTSA-N
- 24799496
MolClass #46336
PTDHVCAMJXFRPV-UHFFFAOYSA-N
- 17387323
MolClass #46337
HONILTXLATVKTO-UHFFFAOYSA-N
- 7976437
MolClass #46338
LIYCQLSOUOZORW-UHFFFAOYSA-N
- 7967606
MolClass #46339
YVBUSFOMMUZDBT-UHFFFAOYSA-N
- 17511464
MolClass #46340
YBGIWLJHDIGCOK-UHFFFAOYSA-N
- 14719080
MolClass #46341
XXVQQNOXIJIQAP-KLCRIKRISA-N
- 17511369
MolClass #46342
LLGXDNBBUQAQNN-ZHZULCJRSA-N
- 24820374
MolClass #46343
ZARKBFWTOBTNDW-BQYQJAHWSA-N
- 14741144
MolClass #46344
OUTQVWPKCYYSKO-RPPGKUMJSA-N
- 24814124
MolClass #46345
ZGAJTIGIGWBWOY-JMCWYTMQSA-N
- 24786410
MolClass #46346
AYIYTQRDNBDFOW-UHFFFAOYSA-N
- 17505114
MolClass #46347
YDXHKFKFGSAHPR-UHFFFAOYSA-N
- 7974579
MolClass #46348
WCLDTQVHHGOWAP-UHFFFAOYSA-N
- 4259756
MolClass #46349
DSQYEZBBAZDPKZ-UHFFFAOYSA-N
- 17401518
MolClass #46350
FJJFELUKXNWMNC-ZMOGYAJESA-N
- 3716384
MolClass #46351
PMSLMKMMVHGGQE-UHFFFAOYSA-N
- 4243429
MolClass #46352
YRJRFCGJICHBHJ-UHFFFAOYSA-N
- 17516921
MolClass #46353
RPJWRECVJHBARY-UHFFFAOYSA-N
- 17505158
MolClass #46354
XSKOHYNSBCCCSO-UHFFFAOYSA-N
- 3717163
MolClass #46355
- 24792442
MolClass #46356
QUORRAFEJPPCPI-UHFFFAOYSA-N
- 24832403
MolClass #46357
IZOCLEMWJOKOSQ-UHFFFAOYSA-N
- 24824244
MolClass #46358
SJBRCDQMJOZDQB-SXWKCWPCSA-N
- 4246620
MolClass #46359
WXNWDFRPQUQBHT-UHFFFAOYSA-N
- 24791547
MolClass #46360
LDQXYWMYZSUTQV-NUGSKGIGSA-N
- 4242074
MolClass #46361
FUKQHJMXLMLBMA-UHFFFAOYSA-N
- 24780166
MolClass #46362
- 14744170
MolClass #46363
NOLFVWIVGUIDAF-UHFFFAOYSA-N
- 14744036
MolClass #46364
DAUBZOOJQHNQKK-UHFFFAOYSA-N
- 24786509
MolClass #46365
WXXGSCQGASBEKQ-UHFFFAOYSA-N
- 14737025
MolClass #46366
OYBPNKPXXAKELN-UHFFFAOYSA-N
- 17514558
MolClass #46367
AKBMKWBXBXHZEA-UHFFFAOYSA-N
- 24785456
MolClass #46368
ZGEQRHXYVQEMQN-UHFFFAOYSA-N
- 17402436
MolClass #46369
PNTNYAROJBIZDO-UHFFFAOYSA-N
- 17515929
MolClass #46370
IZDHKBHNSSFKTE-UHFFFAOYSA-N
- 850847
MolClass #46371
MYXRUFRVJSTKTM-LUAWRHEFSA-N
- 857461
MolClass #46372
ASHPLLYTBYJWQS-UHFFFAOYSA-N
- 864137
MolClass #46373
VJYMWNZRVJBNGM-UHFFFAOYSA-N
- 14745794
MolClass #46374
YWMRSPAWUWXKJU-UHFFFAOYSA-N
- 24818412
MolClass #46375
NUSUDJFZOPVUDR-UHFFFAOYSA-N
- 24801552
MolClass #46376
KLUVOVVACZMJNX-UHFFFAOYSA-N
- 14738300
MolClass #46377
FRJYUUDTHWBANP-UHFFFAOYSA-N
- 14728162
MolClass #46378
- 4241446
MolClass #46379
QUZTWSMTEVXSPF-UHFFFAOYSA-N
- 24780360
MolClass #46380
OHURUUSZJHIVTO-UHFFFAOYSA-N
- 857441
MolClass #46381
JOVJKMYFWUCQGB-UHFFFAOYSA-N
- 14731892
MolClass #46382
- 14742204
MolClass #46383
AIGNVYYHQNVYHQ-UHFFFAOYSA-N
- 864552
MolClass #46384
NEVMOMRLRQYLOS-UHFFFAOYSA-N
- 17513446
MolClass #46385
VLWMUSJPPDIPPS-UHFFFAOYSA-N
- 22404634
MolClass #46386
COKQJJWRZPSSLN-UHFFFAOYSA-N
- 14738070
MolClass #46387
VHSVYPARSNMOEX-UHFFFAOYSA-N
- 17511791
MolClass #46388
BBDIGXVOROOTTB-LTGZKZEYSA-N
- 22406945
MolClass #46389
DOLPHFLTKWHGOO-UHFFFAOYSA-N
- 4261264
MolClass #46390
HQSZKMWMGQDJTF-UHFFFAOYSA-N
- 24817211
MolClass #46391
YROGYKLLIVQYOT-PLNGDYQASA-N
- 24827249
MolClass #46392
WKTSGSNDSJZXHT-UHFFFAOYSA-N
- 863241
MolClass #46393
GXFIAKUGGLKVSC-UHFFFAOYSA-N
- 3715345
MolClass #46394
- 848775
MolClass #46395
LYPKTTBSLULQJR-UHFFFAOYSA-N
- 14725230
MolClass #46396
SVFFZAWSUDKAQB-MDWZMJQESA-N
- 24803821
MolClass #46397
HLIJPUALSQELGB-UHFFFAOYSA-N
- 24813492
MolClass #46398
GTVDAFCDCDJCTF-UHFFFAOYSA-N
- 17505698
MolClass #46399
ZMBMVJNMHOTLSD-ZFJBLLOBSA-N
- 3711316
MolClass #46400
IILFMWQTZZFXTM-UHFFFAOYSA-N