Molecule directory
Explore structures, source datasets and saved model predictions for molecules registered in MolClass.
Search by molecule name, identifier or structure →- 244
MolClass #23401
FMLOADCAWBSWGJ-UHFFFAOYSA-N
- 973
MolClass #23402
VTYFRTLPEJNIRF-UHFFFAOYSA-N
- 273
MolClass #23403
ZMFLYRYPNJTGRJ-UHFFFAOYSA-N
- 1176
MolClass #23404
NYANXTDSHHTYJI-WYMPLXKRSA-N
- 2118
MolClass #23405
PNRDNYQCSJTQER-UHFFFAOYSA-N
- 2212
MolClass #23406
FPHXKNOKCOMNSP-UHFFFAOYSA-N
- 1173
MolClass #23407
FWOWEGODOUCDGO-QPJQQBGISA-N
- 3325
MolClass #23408
RLYZSPFHYXVUAO-QHGDOQTNSA-N
- 2092
MolClass #23409
MOFAGBSSUWKFIS-NVXWUHKLSA-N
- 4152
MolClass #23410
BIYQZBZXGSLYFH-UHFFFAOYSA-N
- 2226
MolClass #23411
PFZIJAVARPSGTC-UHFFFAOYSA-N
- 230
MolClass #23412
FRAKMZAJSDXXBT-IUALRMIASA-N
- 4042
MolClass #23413
ZRXFZCQSBYSHSY-UHFFFAOYSA-N
- 984
MolClass #23414
HEPPXMUCHHOWFH-UHFFFAOYSA-N
- 4020
MolClass #23415
YHSIVKSVNAGOHE-HCBMXOAHSA-N
- 2193
MolClass #23416
DMPJQEFTLWJARV-IUALRMIASA-N
- 266
MolClass #23417
ORHXLXWFKMHILK-UHFFFAOYSA-N
- 4170
MolClass #23418
OGKPBVRUWGDXTB-UHFFFAOYSA-N
- 4397
MolClass #23419
NXHSVNNVHFYXIB-UHFFFAOYSA-N
- 217
MolClass #23420
KRQCEDRNKDJZOG-UHFFFAOYSA-N
- 2082
MolClass #23421
ZKZPMOXTTIRMBF-UHFFFAOYSA-N
- ZINC29907296
MolClass #23422
JAGKUOGUYQRMRS-UHFFFAOYSA-N
- ZINC27539285
MolClass #23423
ZEVYOPYDTXCWDR-UHFFFAOYSA-O
- ZINC12959271
MolClass #23424
GIWPLHJVTUQGKQ-UHFFFAOYSA-N
- ZINC07820612
MolClass #23425
CDZYVJZATJJRKL-UHFFFAOYSA-N
- ZINC11597440
MolClass #23426
BYGGVDPSTWJWFC-UHFFFAOYSA-N
- ZINC25154813
MolClass #23427
GLHVKSZFNQIZBM-UHFFFAOYSA-N
- ZINC15186172
MolClass #23428
XRFUSNMFRLEQRP-UHFFFAOYSA-N
- ZINC06546802
MolClass #23429
LEEWFAOMPLBDLD-UHFFFAOYSA-N
- ZINC19601263
MolClass #23430
FPTIVDQQADDQLN-UHFFFAOYSA-N
- ZINC27417965
MolClass #23431
GNISUPJTXUCCNN-NRFANRHFSA-O
- ZINC11756937
MolClass #23432
SNMHPXWIXMFVQC-UHFFFAOYSA-N
- ZINC05486671
MolClass #23433
MDBVMARSIGFDTH-CQSZACIVSA-N
- ZINC10916174
MolClass #23434
AIPYDYBJYGSLTL-UHFFFAOYSA-N
- ZINC26343420
MolClass #23435
ZQTFQJJSTWIPHD-ZHACJKMWSA-N
- ZINC21872940
MolClass #23436
MRITUMHWLQZQDZ-DEOSSOPVSA-N
- ZINC15067617
MolClass #23437
BJXXBNZGUQPQST-UHFFFAOYSA-O
- ZINC29505640
MolClass #23438
RYVYOJYBCYUVMK-UHFFFAOYSA-N
- ZINC06451738
MolClass #23439
LXKLLEGIXLYMEU-UHFFFAOYSA-N
- ZINC07322023
MolClass #23440
YRZKCCRIRRKLCY-UHFFFAOYSA-N
- ZINC29189577
MolClass #23441
NCCGJLFZBAUTNZ-QFIPXVFZSA-O
- ZINC02931607
MolClass #23442
ILWMWYYXLPBHAJ-UHFFFAOYSA-N
- ZINC00197698
MolClass #23443
GSFWNYXUHRKUPD-GOSISDBHSA-N
- ZINC03505944
MolClass #23444
ZMWNRWAOOYISSN-UHFFFAOYSA-N
- ZINC31314135
MolClass #23445
UANQOODZFUAFSF-UHFFFAOYSA-O
- ZINC29628417
MolClass #23446
CXBNNGKZEWKFRV-UHFFFAOYSA-N
- ZINC14970602
MolClass #23447
- ZINC25405097
MolClass #23448
FCKWSWLCYJAKQO-JTQLQIEISA-N
- ZINC17251266
MolClass #23449
KSTLCHVIQPJDDT-UHFFFAOYSA-N
- ZINC12834067
MolClass #23450
UDZKPBXFZLXWOG-CYBMUJFWSA-N
- ZINC06737526
MolClass #23451
HALUUCRUSZYBNK-MRXNPFEDSA-N
- ZINC03192160
MolClass #23452
SOBWFSJFNTVCRZ-JGCGQSQUSA-N
- ZINC19514252
MolClass #23453
OOARFYRTASAMLP-UHFFFAOYSA-P
- ZINC01495950
MolClass #23454
OBDWGVSTFOWXAM-JTQLQIEISA-N
- ZINC07473076
MolClass #23455
KJIQSLBTYYKMTB-RHSMWYFYSA-N
- ZINC25748328
MolClass #23456
GITGENTZHCDUGK-CQSZACIVSA-N
- ZINC02178610
MolClass #23457
BAKDMPGRRSERSX-UHFFFAOYSA-N
- ZINC19535418
MolClass #23458
SCAONHWMBQKGIL-UHFFFAOYSA-N
- ZINC14824166
MolClass #23459
FDESYNZCSDCHOM-ICGHYTOHSA-O
- ZINC22854409
MolClass #23460
YDCPUJKVFKXSLI-HNNXBMFYSA-N
- ZINC09251486
MolClass #23461
BCMXHWGUCZRQMZ-NRFANRHFSA-N
- ZINC05591958
MolClass #23462
ODMWDGXPWMXGLI-PAKSIRSJSA-O
- ZINC27824578
MolClass #23463
MGJNZLZGEFDKJF-IBGZPJMESA-N
- ZINC02802844
MolClass #23464
ZFCLTNWGNVSZTN-QAPCUYQASA-N
- ZINC20231260
MolClass #23465
SPGSDMHVIMHAPW-UHFFFAOYSA-M
- ZINC06585861
MolClass #23466
HWWKVKTXFBLBEP-UHFFFAOYSA-O
- ZINC01391028
MolClass #23467
CDSLZLKIARJTNZ-YRNVUSSQSA-N
- ZINC05664007
MolClass #23468
HFYYIYVYBXADGP-OAHLLOKOSA-N
- ZINC18036778
MolClass #23469
PGWHZMVCSGWRTA-WONSDZLVSA-O
- ZINC25741597
MolClass #23470
WLZSVXSSFYUSJB-UHFFFAOYSA-N
- ZINC01708782
MolClass #23471
PSFLVVRVXZBCSL-UHFFFAOYSA-O
- ZINC17302822
MolClass #23472
JSULGLNYTBQZQY-UHFFFAOYSA-L
- ZINC12441233
MolClass #23473
RPLWIBHDMPLLFI-KRWDZBQOSA-P
- ZINC09463876
MolClass #23474
MHGNSXGCVGRWTA-UHFFFAOYSA-O
- ZINC21262816
MolClass #23475
QIIBRNBAOZLJIP-SFHVURJKSA-O
- ZINC08426324
MolClass #23476
KSRCFJHTUPUPBN-UHFFFAOYSA-N
- ZINC21733165
MolClass #23477
VPANDYHKWZKHRQ-INIZCTEOSA-N
- ZINC08876764
MolClass #23478
- ZINC20166538
MolClass #23479
- ZINC08398958
MolClass #23480
DKSPMPOYAWOREC-UHFFFAOYSA-N
- ZINC29383967
MolClass #23481
TXILMUGZSWVQKU-UHFFFAOYSA-N
- ZINC20566330
MolClass #23482
AJVDJQGPFDUDAF-KRWDZBQOSA-O
- ZINC08654490
MolClass #23483
YHFTWEOSMIWIEZ-NDENLUEZSA-N
- ZINC06424559
MolClass #23484
LAEJBMPGRCSINE-HZPDHXFCSA-N
- ZINC12363527
MolClass #23485
QELURTLOGMHNAX-UHFFFAOYSA-N
- ZINC13788797
MolClass #23486
LZYZEGUKURXKBP-UHFFFAOYSA-N
- ZINC23581709
MolClass #23487
JCRZWGUXZAWWAT-OAHLLOKOSA-N
- ZINC12419043
MolClass #23488
UVFHIKPSHOJNCZ-UHFFFAOYSA-N
- ZINC20274017
MolClass #23489
CFHWHLNLDHMAOV-CYBMUJFWSA-O
- ZINC20006878
MolClass #23490
FQGNWBAOLOSPGB-LBPRGKRZSA-N
- ZINC02486880
MolClass #23491
OUJBCSAFUZEXMG-INIZCTEOSA-N
- ZINC12794813
MolClass #23492
DTPGYVBZRUWLOK-UHFFFAOYSA-N
- ZINC00547088
MolClass #23493
UKLJMKFVTBGOBH-QGZVFWFLSA-N
- ZINC23224111
MolClass #23494
ZBUGXFWWIROVGX-QJNRRLCJSA-N
- ZINC22759700
MolClass #23495
DCWIHDINPQKOSK-UHFFFAOYSA-N
- ZINC11725233
MolClass #23496
GLFKBPGVYPEPJM-UHFFFAOYSA-N
- ZINC04794577
MolClass #23497
- ZINC10876081
MolClass #23498
QSUMKEJGRXKHSM-AWEZNQCLSA-N
- ZINC14410895
MolClass #23499
PKBKMYVOWSFRKW-VWLOTQADSA-N
- ZINC25754376
MolClass #23500
ZZECBCFIIGUATA-UHFFFAOYSA-N