Molecule directory
Explore structures, source datasets and saved model predictions for molecules registered in MolClass.
Search by molecule name, identifier or structure →- LOPAC 00880
MolClass #401
FMETVQKSDIOGPX-UHFFFAOYSA-N
- LOPAC 00847
MolClass #402
OTKJDMGTUTTYMP-UHFFFAOYSA-N
- LOPAC 00854
MolClass #403
USXYDBGSWSSTGE-UHFFFAOYSA-N
- LOPAC 00860
MolClass #404
- LOPAC 00283
MolClass #405
WTDRDQBEARUVNC-UHFFFAOYSA-N
- LOPAC 00699
MolClass #406
FBOZXECLQNJBKD-UHFFFAOYSA-N
- LOPAC 00276
MolClass #407
GOTMKOSCLKVOGG-UHFFFAOYSA-N
- LOPAC 00184
MolClass #408
YAWWQIFONIPBKT-UHFFFAOYSA-N
- LOPAC 00361
MolClass #409
YQLZOAVZWJBZSY-UHFFFAOYSA-N
- LOPAC 00874
MolClass #410
BQJODPIMMWWMFC-UHFFFAOYSA-N
- LOPAC 00848
MolClass #411
UUFAJPMQSFXDFR-UHFFFAOYSA-N
- LOPAC 00855
MolClass #412
AGKRHAILCPYNFH-DUQSFWPASA-N
- LOPAC 00861
MolClass #413
MASYAWHPJCQLSW-UHFFFAOYSA-N
- LOPAC 00035
MolClass #414
IZEKFCXSFNUWAM-UHFFFAOYSA-N
- LOPAC 00268
MolClass #415
LMYSNFBROWBKMB-UHFFFAOYSA-N
- LOPAC 00506
MolClass #416
BGMZUEKZENQUJY-UHFFFAOYSA-N
- LOPAC 00039
MolClass #417
BUHVIAUBTBOHAG-UHFFFAOYSA-N
- LOPAC 01329
MolClass #418
ALSKYCOJJPXPFS-UHFFFAOYSA-N
- LOPAC 00010
MolClass #419
JADDQZYHOWSFJD-UHFFFAOYSA-N
- LOPAC 00849
MolClass #420
ROFVEXUMMXZLPA-UHFFFAOYSA-N
- LOPAC 00481
MolClass #421
VQLPLYSROCPWFF-UHFFFAOYSA-N
- LOPAC 00862
MolClass #422
- LOPAC 00867
MolClass #423
RUZYUOTYCVRMRZ-UHFFFAOYSA-N
- LOPAC 00174
MolClass #424
GIJXKZJWITVLHI-UHFFFAOYSA-N
- LOPAC 00587
MolClass #425
CZJMQTZQSNUDNV-UHFFFAOYSA-N
- LOPAC 00588
MolClass #426
VDCDWNDTNSWDFJ-UHFFFAOYSA-N
- LOPAC 00877
MolClass #427
- LOPAC 00883
MolClass #428
LTLYEAJONXGNFG-UHFFFAOYSA-N
- LOPAC 00884
MolClass #429
PQCXVIPXISBFPN-UHFFFAOYSA-N
- LOPAC 00892
MolClass #430
QUVZKDZYEOYGKV-UHFFFAOYSA-N
- LOPAC 00227
MolClass #431
PIJVFDBKTWXHHD-UHFFFAOYSA-N
- LOPAC 00904
MolClass #432
RKXSQHTWNMDLJM-UHFFFAOYSA-N
- LOPAC 00909
MolClass #433
RTHCYVBBDHJXIQ-UHFFFAOYSA-N
- LOPAC 00410
MolClass #434
YMTINGFKWWXKFG-UHFFFAOYSA-N
- LOPAC 00432
MolClass #435
OHCQJHSOBUTRHG-UHFFFAOYSA-N
- LOPAC 00925
MolClass #436
RWTNPBWLLIMQHL-UHFFFAOYSA-N
- LOPAC 00929
MolClass #437
BYGXICRJQZKUPA-UHFFFAOYSA-N
- LOPAC 00934
MolClass #438
IRMTXMJNHRISQH-UHFFFAOYSA-N
- LOPAC 00885
MolClass #439
VFIZBHJTOHUOEK-UHFFFAOYSA-N
- LOPAC 00893
MolClass #440
HDFGOPSGAURCEO-UHFFFAOYSA-N
- LOPAC 00899
MolClass #441
KNADXBVKFAUMCR-UHFFFAOYSA-N
- LOPAC 00905
MolClass #442
YKPCEENRZZBDMC-UHFFFAOYSA-N
- LOPAC 00593
MolClass #443
CJOFXWAVKWHTFT-XSFVSMFZSA-N
- LOPAC 00913
MolClass #444
FVNFBBAOMBJTST-UHFFFAOYSA-N
- LOPAC 00919
MolClass #445
XUFQPHANEAPEMJ-UHFFFAOYSA-N
- LOPAC 00926
MolClass #446
KQYRMZUHUNAFOD-UHFFFAOYSA-N
- LOPAC 00193
MolClass #447
ZNNLBTZKUZBEKO-UHFFFAOYSA-N
- LOPAC 01308
MolClass #448
QTQMRBZOBKYXCG-UHFFFAOYSA-N
- LOPAC 00114
MolClass #449
UCTWMZQNUQWSLP-UHFFFAOYSA-N
- LOPAC 00900
MolClass #450
VOXZDWNPVJITMN-UHFFFAOYSA-N
- LOPAC 00043
MolClass #451
IOSAAWHGJUZBOG-UHFFFAOYSA-N
- LOPAC 00910
MolClass #452
DIGWWZCEDODOMZ-UHFFFAOYSA-N
- LOPAC 00914
MolClass #453
OFBIFZUFASYYRE-UHFFFAOYSA-N
- LOPAC 00920
MolClass #454
- LOPAC 00927
MolClass #455
RZTAMFZIAATZDJ-UHFFFAOYSA-N
- LOPAC 00930
MolClass #456
DYYZXRCFCVDSKD-UHFFFAOYSA-N
- LOPAC 00935
MolClass #457
LMXYVLFTZRPNRV-KMKOMSMNSA-N
- LOPAC 00887
MolClass #458
VWLHWLSRQJQWRG-UHFFFAOYSA-O
- LOPAC 00894
MolClass #459
DEFVIWRASFVYLL-UHFFFAOYSA-N
- LOPAC 00901
MolClass #460
DNXHEGUUPJUMQT-UHFFFAOYSA-N
- LOPAC 00282
MolClass #461
- LOPAC 00911
MolClass #462
VHWFITPGPFLBGT-UHFFFAOYSA-M
- LOPAC 00915
MolClass #463
IUPYLWAXGAJZQC-UHFFFAOYSA-N
- LOPAC 00921
MolClass #464
WUILNKCFCLNXOK-CFBAGHHKSA-N
- LOPAC 00284
MolClass #465
QOYHHIBFXOOADH-UHFFFAOYSA-N
- LOPAC 00931
MolClass #466
INJOMKTZOLKMBF-UHFFFAOYSA-N
- LOPAC 00433
MolClass #467
TZBJGXHYKVUXJN-UHFFFAOYSA-N
- LOPAC 00888
MolClass #468
RATZLMXRALDSJW-UHFFFAOYSA-N
- LOPAC 00902
MolClass #469
- LOPAC 00351
MolClass #470
WKGXYQFOCVYPAC-UHFFFAOYSA-N
- LOPAC 01306
MolClass #471
WDTAYDBPNYFWDR-UHFFFAOYSA-N
- LOPAC 00617
MolClass #472
DGMPVYSXXIOGJY-UHFFFAOYSA-N
- LOPAC 00190
MolClass #473
SMANXXCATUTDDT-QPJJXVBHSA-N
- LOPAC 00827
MolClass #474
MKXZASYAUGDDCJ-UHFFFAOYSA-N
- LOPAC 00366
MolClass #475
WHUUTDBJXJRKMK-UHFFFAOYSA-N
- LOPAC 01309
MolClass #476
PKNYXWMTHFMHKD-UHFFFAOYSA-N
- LOPAC 00889
MolClass #477
- LOPAC 00897
MolClass #478
HAPOVYFOVVWLRS-UHFFFAOYSA-N
- LOPAC 00614
MolClass #479
- LOPAC 00906
MolClass #480
IECPWNUMDGFDKC-LHLOQNFPSA-M
- LOPAC 00044
MolClass #481
PJALBCRHHXTHAF-UHFFFAOYSA-N
- LOPAC 00916
MolClass #482
GHASVSINZRGABV-UHFFFAOYSA-N
- LOPAC 00922
MolClass #483
ZWAOHEXOSAUJHY-UHFFFAOYSA-N
- LOPAC 01334
MolClass #484
- LOPAC 00932
MolClass #485
IRSCQMHQWWYFCW-UHFFFAOYSA-N
- LOPAC 00936
MolClass #486
RHVVRMJOHATSPD-UHFFFAOYSA-N
- LOPAC 00890
MolClass #487
DYEFUKCXAQOFHX-UHFFFAOYSA-N
- LOPAC 00898
MolClass #488
GXEKYRXVRROBEV-UHFFFAOYSA-N
- LOPAC 00903
MolClass #489
- LOPAC 00907
MolClass #490
LSLYOANBFKQKPT-UHFFFAOYSA-N
- LOPAC 00912
MolClass #491
XWHHYOYVRVGJJY-UHFFFAOYSA-N
- LOPAC 00917
MolClass #492
DJBNUMBKLMJRSA-UHFFFAOYSA-N
- LOPAC 00923
MolClass #493
JUUFBMODXQKSTD-UHFFFAOYSA-N
- LOPAC 00191
MolClass #494
- LOPAC 00367
MolClass #495
ZDXPYRJPNDTMRX-UHFFFAOYSA-N
- LOPAC 00192
MolClass #496
OZLPUNFFCJDMJD-UHFFFAOYSA-N
- LOPAC 00891
MolClass #497
USUMXADKOISKIL-UHFFFAOYSA-N
- LOPAC 00595
MolClass #498
RHMXXJGYXNZAPX-UHFFFAOYSA-N
- LOPAC 00189
MolClass #499
HKGWQUVGHPDEBZ-UHFFFAOYSA-N
- LOPAC 00253
MolClass #500
ZPEIMTDSQAKGNT-UHFFFAOYSA-N