Molecule directory
Explore structures, source datasets and saved model predictions for molecules registered in MolClass.
Search by molecule name, identifier or structure →- 4356-1378
MolClass #24401
YBMJMNSLRMPCKO-YPKPFQOOSA-N
- 4371-6384
MolClass #24402
KLIISPIJXODJBI-HMAPJEAMSA-N
- 4449-1405
MolClass #24403
PIAXNVBUZPYAGZ-CXUHLZMHSA-N
- 4449-1925
MolClass #24404
AHGKQJOBGXUHFF-IZZDOVSWSA-N
- 4469-0432
MolClass #24405
ZXHCMKPAXABHSR-UHFFFAOYSA-N
- 4469-0604
MolClass #24406
QQDAIBUEPKCZLS-UHFFFAOYSA-N
- 4476-0252
MolClass #24407
SWWQWPJRZSPMMQ-UHFFFAOYSA-N
- 4476-0270
MolClass #24408
LKTUJASDDXLJIC-UHFFFAOYSA-N
- 4476-1849
MolClass #24409
OQRWVRHXLAZKRP-UHFFFAOYSA-N
- 4476-4106
MolClass #24410
RUIMACCKBISKJH-UHFFFAOYSA-N
- 4478-4729
MolClass #24411
PPRRPBWYTHDAKP-XDHOZWIPSA-N
- 4479-0556
MolClass #24412
HWTUTDXHWQLDFZ-UHFFFAOYSA-N
- 1000-0257
MolClass #24413
CSAKNYVJHABGCT-UHFFFAOYSA-N
- 4649-0220
MolClass #24414
QEWPLKIICNLJES-SSZFMOIBSA-N
- 4676-1076
MolClass #24415
ADSTUSPWWHPJQL-YBFXNURJSA-N
- 4854-0030
MolClass #24416
PQHOEQGYFYWQLL-UHFFFAOYSA-N
- 4896-1256
MolClass #24417
NKOUDWIMOKKMNQ-UHFFFAOYSA-N
- 2108-1341
MolClass #24418
XNJXJYNFPJMVNF-CNHKJKLMSA-N
- 4896-5188
MolClass #24419
MNFFIIITZCYDIF-MLPAPPSSSA-N
- 4896-5204
MolClass #24420
IHFNWFGILYKHGO-ZSOIEALJSA-N
- 4896-5243
MolClass #24421
XNTMRKYKVLEFLO-ZSOIEALJSA-N
- 4896-5245
MolClass #24422
UJECLVZGFYNCOJ-YBEGLDIGSA-N
- 4896-5304
MolClass #24423
OOIUIJRCLGTMEK-ZSOIEALJSA-N
- 4896-5349
MolClass #24424
ABRWDZBHBOWGSY-WCIBSUBMSA-N
- 5043-0016
MolClass #24425
JVXCKJLNCAQSNA-HMMYKYKNSA-N
- 5186-0397
MolClass #24426
UPHYVKGODXLYCF-UHFFFAOYSA-N
- 5186-0398
MolClass #24427
OTCVEBGHBZITPZ-UHFFFAOYSA-N
- 5311-0132
MolClass #24428
HRMBLFNBKLEZKA-RVDMUPIBSA-N
- 5432-0037
MolClass #24429
KOOVIFRZHUTMLX-VCHYOVAHSA-N
- 5682-0009
MolClass #24430
YUIBEWRQJYJCMH-QINSGFPZSA-N
- 5682-0014
MolClass #24431
KFZSKYPHLROHDG-UVTDQMKNSA-N
- 5682-0074
MolClass #24432
RPEHNADGJBGLGJ-PTNGSMBKSA-N
- 5895-0010
MolClass #24433
GUVWKXLQBOLHOI-ZROIWOOFSA-N
- 8001-2346
MolClass #24434
- 1636-0257
MolClass #24435
QDUHPOFQZYEJFL-LICLKQGHSA-N
- 8001-9289
MolClass #24436
ZUGCPUKZDCRAGY-QHPKCYJTSA-N
- 3253-0416
MolClass #24437
WEBVYEVUWMNOFQ-GIDUJCDVSA-N
- 1523-5774
MolClass #24438
YPSWITZYSSEKGU-AUWJEWJLSA-N
- 8002-5376
MolClass #24439
KGCYXXXRJPTESQ-UHFFFAOYSA-N
- 8002-7864
MolClass #24440
XTMHHDJBCNCRBM-FLIBITNWSA-N
- 8002-9863
MolClass #24441
ZFGXZJKLOFCECI-UHFFFAOYSA-N
- 8003-0803
MolClass #24442
FEAOBRNDJKXIGL-ZVHZXABRSA-N
- 8003-2415
MolClass #24443
VINPUUQDSGMVEC-OEAKJJBVSA-N
- 8003-7927
MolClass #24444
HCLPIVKXPCOBLG-OEAKJJBVSA-N
- 8003-8143
MolClass #24445
NNRIAIUCUSDECF-VCHYOVAHSA-N
- 8003-9095
MolClass #24446
VIYQTAYCCLEHIB-CIAFOILYSA-N
- 8003-9574
MolClass #24447
MQPIEKIYEIBZKM-FRKPEAEDSA-N
- 8004-0254
MolClass #24448
UXGNZCQMGPQYAK-YDZHTSKRSA-N
- 8004-0279
MolClass #24449
MSCJUURDUNFVPB-HYARGMPZSA-N
- 0596-0032
MolClass #24450
BNBBLDQDZZCMRB-OAMFTAOGSA-N
- 8004-1427
MolClass #24451
IKUGYVJTVAIZMU-SXGWCWSVSA-N
- 8004-2736
MolClass #24452
BZFLBXIMBJCOFL-YBFXNURJSA-N
- 8004-3093
MolClass #24453
CJJFAJACQXUONF-UHFFFAOYSA-N
- 8004-4089
MolClass #24454
UAXMRHVONHERTJ-OVCLIPMQSA-N
- 2009-1465
MolClass #24455
BHQBTXVWSVGLGN-REZTVBANSA-N
- 8004-4273
MolClass #24456
QYHHTVCKLVNCOL-UBKPWBPPSA-N
- 8004-4471
MolClass #24457
CLURVFGXBGNBKA-FRKPEAEDSA-N
- 8005-1425
MolClass #24458
TZASBTXZRPPFHT-ZHZULCJRSA-N
- 8005-1521
MolClass #24459
SWNSOBWYZDWQNJ-IFRROFPPSA-N
- 0590-0525
MolClass #24460
KWOYWPHTHPVIAL-SDNWHVSQSA-N
- 8005-7538
MolClass #24461
CVFDRXZXSBOGRK-REZTVBANSA-N
- 4076-0222
MolClass #24462
- 8005-8620
MolClass #24463
SIJKIKVQBXSCFY-CIAFOILYSA-N
- 8006-1809
MolClass #24464
ONMMAERKDGQZBL-QGMBQPNBSA-N
- 8006-5314
MolClass #24465
PPVKFFMSPUKRKF-REZTVBANSA-N
- 8006-5344
MolClass #24466
VFWXHSYFAPUDBC-CXUHLZMHSA-N
- 1699-1961
MolClass #24467
DDQQTDUTEJRPLM-CAOOACKPSA-N
- 8007-8341
MolClass #24468
NUIXWYJEHWJXCG-RGVLZGJSSA-N
- 8008-3055
MolClass #24469
WXDOHQIHQAFQJH-YZSQISJMSA-N
- 8008-5780
MolClass #24470
PWZZFWYVQUVFIU-CNHKJKLMSA-N
- 8008-6103
MolClass #24471
OEBDLVHMQPFEJY-CNHKJKLMSA-N
- 8002-2326
MolClass #24472
BVHMEFSSKQMPSI-DHRITJCHSA-N
- 8008-8749
MolClass #24473
QTCBVCMEJTUCSW-UHFFFAOYSA-N
- 8011-8270
MolClass #24474
BESWDSGEMIBHER-UHFFFAOYSA-N
- 8013-1348
MolClass #24475
BNSHKSGHHCPPDV-VMPITWQZSA-N
- C064-0401
MolClass #24476
PXNBONAIODGPAD-UHFFFAOYSA-N
- C131-0029
MolClass #24477
BGIMHSVXGBCBSU-ZSOIEALJSA-N
- C131-0049
MolClass #24478
RPMIFQJIDZJQIO-QPEQYQDCSA-N
- C285-0027
MolClass #24479
SGSDWTOGCIZTRW-LCYFTJDESA-N
- C285-0046
MolClass #24480
DMSZQDRYZMKMNJ-LCYFTJDESA-N
- K075-2837
MolClass #24481
PFMMUFYRTOIGRD-AUWJEWJLSA-N
- K088-0918
MolClass #24482
RHMUBPKLMTXGCI-ZROIWOOFSA-N
- 3681-1190
MolClass #24483
OMLQLOPFHAOOJQ-UHFFFAOYSA-N
- K241-0204
MolClass #24484
WHPVYKRWCRLFEO-UHFFFAOYSA-N
- K832-1618
MolClass #24485
JQOFMQFKKFWGHG-UHFFFAOYSA-N
- K939-0003
MolClass #24486
NWARFCHBQFFBGZ-LCYFTJDESA-N
- K939-0004
MolClass #24487
YKQONSWBHGBDSB-XFXZXTDPSA-N
- K939-0006
MolClass #24488
KOUZXSJKYSEQBE-XFXZXTDPSA-N
- K939-0012
MolClass #24489
BZWZITZVOQYHCA-LCYFTJDESA-N
- K939-0013
MolClass #24490
IRQQWCZKCUQNSO-WJDWOHSUSA-N
- K939-0042
MolClass #24491
RMHHLJOBJAHRMS-ATVHPVEESA-N
- K939-0048
MolClass #24492
OGXXXTZOASJJBC-GDNBJRDFSA-N
- K939-0049
MolClass #24493
XIZVTPOJOYBLOF-ZROIWOOFSA-N
- K939-0050
MolClass #24494
SMNHRBNIYSORCH-UVTDQMKNSA-N
- N025-0038
MolClass #24495
RLKKSOCKDSDBCS-UHFFFAOYSA-N
- 000A-0413
MolClass #24496
VCHQVZAODIWELS-UHFFFAOYSA-N
- 0054-0133
MolClass #24497
HEASJCRVYKCKOY-UHFFFAOYSA-N
- 0073-0061
MolClass #24498
BBVSHQVJVVQWPK-UHFFFAOYSA-N
- 0080-0066
MolClass #24499
XCSZAOTVVIRTGB-UHFFFAOYSA-N
- 0234-0008
MolClass #24500
AVQFHKYAVVQYQO-UHFFFAOYSA-N