Molecule directory
Explore structures, source datasets and saved model predictions for molecules registered in MolClass.
Search by molecule name, identifier or structure →- 4246099
MolClass #37301
UNMRUMQKBZIHLM-UHFFFAOYSA-N
- 14743504
MolClass #37302
XMTQMOBJTDTIHE-SEYXRHQNSA-N
- 22415511
MolClass #37303
VSFIFIOEYMXOMJ-UHFFFAOYSA-N
- 14738952
MolClass #37304
OSPVKINWJBBBAL-UHFFFAOYSA-N
- 24799421
MolClass #37305
URJHENWRLNYCHY-UHFFFAOYSA-N
- 24832116
MolClass #37306
TYUBQQZNYXUYFD-UHFFFAOYSA-N
- 17411583
MolClass #37307
CYYZSGYEAZJPDJ-NTUHNPAUSA-N
- 4263543
MolClass #37308
- 24824549
MolClass #37309
ICBQMUXQZBRNMY-UHFFFAOYSA-N
- 3713746
MolClass #37310
- 17514407
MolClass #37311
SNTHDKSUBNNJPZ-UHFFFAOYSA-N
- 24835937
MolClass #37312
GZRXZWINOPVBQS-UHFFFAOYSA-N
- 14718900
MolClass #37313
FGOBLJOSAOATPJ-OVCLIPMQSA-N
- 24794238
MolClass #37314
PDZNUYPGXCZLNO-UHFFFAOYSA-N
- 4258219
MolClass #37315
QJFRTGCPUWMXRD-UHFFFAOYSA-N
- 14726452
MolClass #37316
XHFDAASWEKNZNM-ACCUITESSA-N
- 24797933
MolClass #37317
VHWBCWSGVRHVST-UHFFFAOYSA-N
- 7964727
MolClass #37318
ZKYUVZCRDBYNON-UHFFFAOYSA-N
- 850153
MolClass #37319
- 7965074
MolClass #37320
LRDBXJXSQCFIQO-UHFFFAOYSA-N
- 22412948
MolClass #37321
VCRCMBDSDSYJIU-VAWYXSNFSA-N
- 3711659
MolClass #37322
XRWCDZRZKPXNSI-UHFFFAOYSA-N
- 24792426
MolClass #37323
BCBALTUMYNUUTB-UHFFFAOYSA-N
- 24782711
MolClass #37324
OQCZJUXQKCXTJG-MKMNVTDBSA-N
- 4263352
MolClass #37325
SCBINQANYKUIDB-UHFFFAOYSA-N
- 3713883
MolClass #37326
JQKSXQJUSYSINB-UHFFFAOYSA-N
- 14737072
MolClass #37327
PEKWLLJAECDNDK-UHFFFAOYSA-N
- 14739249
MolClass #37328
SSDQHOMLUVVACD-VOTSOKGWSA-N
- 17505058
MolClass #37329
MKIPJMXZSCYPBN-UHFFFAOYSA-N
- 14737425
MolClass #37330
JEDIBJWOEOQXHT-UHFFFAOYSA-N
- 7973819
MolClass #37331
HJPMCRSXEXTVRQ-UHFFFAOYSA-N
- 17406868
MolClass #37332
ZICCATFUQUTYCA-UHFFFAOYSA-N
- 24783153
MolClass #37333
BOXZASCELYHHLN-UHFFFAOYSA-N
- 22405230
MolClass #37334
RVAWCIVCQXQAJS-KEBDBYFISA-N
- 3715029
MolClass #37335
HIHOZGQVOONEEO-ZROIWOOFSA-N
- 17432672
MolClass #37336
VDZZUTLSGXXZHK-UHFFFAOYSA-N
- 24820280
MolClass #37337
BYUQWGMUTWEUBP-UHFFFAOYSA-N
- 24824262
MolClass #37338
WEPCMOYNEXOHLV-UHFFFAOYSA-N
- 24816631
MolClass #37339
SRKDHJGZAHLCKS-UHFFFAOYSA-N
- 24800646
MolClass #37340
PCLJRUFFIAQPFH-UHFFFAOYSA-N
- 17411772
MolClass #37341
VINNEDPDUAJQSC-NTUHNPAUSA-N
- 24821653
MolClass #37342
DEHRBVPGHLIAFC-UHFFFAOYSA-N
- 17414551
MolClass #37343
SLKUYXGMWFCOTI-QDUUWUCGSA-N
- 24841326
MolClass #37344
- 855978
MolClass #37345
PIPAJLPNWZMYQA-KNCRFDSUSA-N
- 850927
MolClass #37346
RNZWTILXZREAFD-UHFFFAOYSA-N
- 24822096
MolClass #37347
RUQLOFJYCULHDV-UHFFFAOYSA-N
- 24823666
MolClass #37348
- 24823711
MolClass #37349
BBCOKDSDZXXYGC-UHFFFAOYSA-N
- 24804475
MolClass #37350
VLIIQFSOLGSFLT-UHFFFAOYSA-N
- 24780458
MolClass #37351
BXYVEJCBZKVZOP-UHFFFAOYSA-N
- 17432064
MolClass #37352
SEKVKQCZTWXZKR-UHFFFAOYSA-N
- 7965312
MolClass #37353
WSGCITCDIYWVOQ-UHFFFAOYSA-N
- 847671
MolClass #37354
- 24837618
MolClass #37355
- 4265421
MolClass #37356
NFRGIKMRXSNQRY-UHFFFAOYSA-N
- 24781351
MolClass #37357
MBVOWKPTYXIWFT-RIYZIHGNSA-N
- 4262241
MolClass #37358
YINWBWZJNJPIHX-UHFFFAOYSA-N
- 7977386
MolClass #37359
SWKVXATYIDRWNL-SSZFMOIBSA-N
- 17387961
MolClass #37360
KAXSFFGYJLIBNI-UHFFFAOYSA-N
- 17505324
MolClass #37361
VVNHMRWOYBFSMA-UHFFFAOYSA-N
- 22413820
MolClass #37362
AXKLWJOPUQVVIY-OVCLIPMQSA-N
- 4247075
MolClass #37363
UGGPGVHLNUJNLN-UHFFFAOYSA-N
- 4244587
MolClass #37364
PVMKFXMDGGVESK-UHFFFAOYSA-N
- 17386637
MolClass #37365
WKKFXMPDENJIDJ-UHFFFAOYSA-N
- 863500
MolClass #37366
IRWOJCAOZNYVRF-MDZDMXLPSA-N
- 22401508
MolClass #37367
- 4263007
MolClass #37368
- 24786522
MolClass #37369
MODLHVPPZIRYIW-UHFFFAOYSA-N
- 14738089
MolClass #37370
HYLFWCNHNCDAPV-ACCUITESSA-N
- 17409625
MolClass #37371
AEQDVZGMJUNYLN-UHFFFAOYSA-N
- 4241042
MolClass #37372
YJZLZQZNTOFYKQ-UHFFFAOYSA-N
- 14747016
MolClass #37373
MNQRKMCBRUEKMB-UHFFFAOYSA-N
- 3712863
MolClass #37374
WWABCQYCGOTNPE-UHFFFAOYSA-N
- 14729365
MolClass #37375
SYJUGUGPKFQWAV-UHFFFAOYSA-N
- 4252166
MolClass #37376
BTRMJSCMTQSDMB-NTCAYCPXSA-N
- 17515372
MolClass #37377
PJQBNQWXRQYSNG-UHFFFAOYSA-N
- 24799061
MolClass #37378
PFHYHNMNKSHJTL-UVFQYZLESA-N
- 24784420
MolClass #37379
YZMQPHRXELNUFA-UHFFFAOYSA-N
- 24793364
MolClass #37380
- 7968347
MolClass #37381
FQUZIXADWRGPRH-UHFFFAOYSA-N
- 4256158
MolClass #37382
- 17386213
MolClass #37383
AORBCEMGUXXYDB-YBEGLDIGSA-N
- 14737679
MolClass #37384
VNHUSQSYRXNIKP-JQIJEIRASA-N
- 11532954
MolClass #37385
LQANGKSBLPMBTJ-BRSNVKEHSA-N
- 7976468
MolClass #37386
MHVLKEBYKIKILD-UHFFFAOYSA-N
- 3713836
MolClass #37387
OAMPTHUGDBMHER-UHFFFAOYSA-N
- 7966999
MolClass #37388
PEUFFNGXFNXAIU-UHFFFAOYSA-N
- 4257973
MolClass #37389
UYNJOUGVRWDHHU-UHFFFAOYSA-N
- 14730000
MolClass #37390
QOBWRFJBVDPEJL-UHFFFAOYSA-N
- 4244257
MolClass #37391
- 4243474
MolClass #37392
MBWDYGJTLDCIIF-UHFFFAOYSA-N
- 7968470
MolClass #37393
OCWSSWUBNZJSRH-UHFFFAOYSA-N
- 24820500
MolClass #37394
- 17401888
MolClass #37395
- 24829927
MolClass #37396
LWAXDVVBVHYRKL-UHFFFAOYSA-N
- 3714422
MolClass #37397
JPYWWAYEZKAZKM-UHFFFAOYSA-N
- 17511032
MolClass #37398
KBLKVWYIYNRRIW-LTGZKZEYSA-N
- 24820981
MolClass #37399
YUCJVWLNVSVTMS-UHFFFAOYSA-N
- 17386655
MolClass #37400
WQJHCJRBEYRRKP-XVNBXDOJSA-N