Molecule directory
Explore structures, source datasets and saved model predictions for molecules registered in MolClass.
Search by molecule name, identifier or structure →- 1917434
MolClass #13001
LIGAXZFBQDPINT-GIJQJNRQSA-N
- 1917440
MolClass #13002
RVTSCQRWSIDRJL-QQQPHYRHSA-N
- 1125849
MolClass #13003
BGWRFFJWGRAKLP-UHFFFAOYSA-N
- 1917400
MolClass #13004
PLYQRHWXINDTOM-UFWORHAWSA-N
- 1917449
MolClass #13005
JASRPWJUMSSFDS-UHFFFAOYSA-N
- 1917453
MolClass #13006
LKTNEXPODAWWFM-UHFFFAOYSA-N
- 1917454
MolClass #13007
ILSXMAUAOIZOBA-UHFFFAOYSA-N
- 1380597
MolClass #13008
IKDXEPTZBJSZTO-UHFFFAOYSA-N
- 1033078
MolClass #13009
MOUVJGIRLPZEES-UHFFFAOYSA-N
- 1130805
MolClass #13010
- 1335580
MolClass #13011
ZJNQRITVJGUHTL-UHFFFAOYSA-N
- 1917480
MolClass #13012
JZZHIOXKDAFLOV-UFWORHAWSA-N
- 1917481
MolClass #13013
KJAMZCVTJDTESW-UHFFFAOYSA-N
- 1917484
MolClass #13014
HOCQBBFSEOFONT-UHFFFAOYSA-N
- 1917487
MolClass #13015
RNZUDPKMBBZDPS-ZVHZXABRSA-N
- 1917492
MolClass #13016
NFLXZSYZWUTEOX-UHFFFAOYSA-N
- 1568074
MolClass #13017
NGBCIYMHXHUPJG-UHFFFAOYSA-N
- 1917506
MolClass #13018
AWBINKYZMQVHJO-VZUCSPMQSA-N
- 1184058
MolClass #13019
UKAIAWABJOKUOR-UHFFFAOYSA-N
- 1917520
MolClass #13020
XWBCFSPHSFEACS-UHFFFAOYSA-N
- 1917522
MolClass #13021
ITRAGDODVWDDEE-RMKNXTFCSA-N
- 1430581
MolClass #13022
AUXCHYJDVJZEPG-UHFFFAOYSA-N
- 1917539
MolClass #13023
UGFSLKRMHPGLFU-UHFFFAOYSA-N
- 1433413
MolClass #13024
- 1917544
MolClass #13025
- 1917551
MolClass #13026
QIYSTBUWARGWON-WHYMJUELSA-N
- 1917552
MolClass #13027
YWAOCPLEJJCYHC-UHFFFAOYSA-N
- 1917554
MolClass #13028
SBFVBDAIBAHHNW-UHFFFAOYSA-N
- 1371234
MolClass #13029
DKJKCAUMSQTYMP-UHFFFAOYSA-N
- 1599387
MolClass #13030
LIFUNLRAAWKRJV-UHFFFAOYSA-N
- 1917565
MolClass #13031
XYBVIPSETKJSHZ-UHFFFAOYSA-N
- 1917567
MolClass #13032
URWYBZHQPYUVNK-UHFFFAOYSA-N
- 1696115
MolClass #13033
HQMPUWYVYYFFSK-UHFFFAOYSA-N
- 1917580
MolClass #13034
JFMVGTHZMQOEEU-UHFFFAOYSA-N
- 1244471
MolClass #13035
ZQLSTGALJGDIEY-UHFFFAOYSA-N
- 1917595
MolClass #13036
MDERWWDLJWAWNN-UHFFFAOYSA-N
- 1917610
MolClass #13037
FRCWAQMDSSPPFN-BJMVGYQFSA-N
- 1917614
MolClass #13038
VZTHUHAJEZPWNC-UHFFFAOYSA-N
- 1305565
MolClass #13039
TVXMKVJQQHBZPQ-UHFFFAOYSA-N
- 1537846
MolClass #13040
KQKVDCCZURCHDA-UHFFFAOYSA-N
- 1708125
MolClass #13041
IOUOXCTVEMOIEJ-UHFFFAOYSA-N
- 1917620
MolClass #13042
ZBSMHFCFSMTDBI-UHFFFAOYSA-N
- 1917621
MolClass #13043
BGXNTKHLBHZYLC-UHFFFAOYSA-N
- 1917629
MolClass #13044
QZDQIDWYIFEOFP-XMHGGMMESA-N
- 1917639
MolClass #13045
- 1917648
MolClass #13046
QEXFBTWEHWPJHE-SRZZPIQSSA-N
- 1917672
MolClass #13047
IIHWHXKZEASIPH-UHFFFAOYSA-N
- 1917685
MolClass #13048
PPTAJMUWWRXREI-UHFFFAOYSA-N
- 1917692
MolClass #13049
CHSCODSBFVPMSQ-UHFFFAOYSA-N
- 1917693
MolClass #13050
JMGPVIBANYWBIS-LVZFUZTISA-N
- 1917694
MolClass #13051
- 1236632
MolClass #13052
DTRJAYJJIYBWRG-UHFFFAOYSA-N
- 1380097
MolClass #13053
QYPVGIIMYGUYNU-UHFFFAOYSA-N
- 1917695
MolClass #13054
FFPRYSXUVZEAQK-UHFFFAOYSA-N
- 1917697
MolClass #13055
IXRIZRKBHVSTSP-UHFFFAOYSA-N
- 1917699
MolClass #13056
SBVPKRPODDSRAN-CVKSISIWSA-N
- 1401898
MolClass #13057
NNVUWMNSPHOFBR-UHFFFAOYSA-N
- 1478246
MolClass #13058
MLKJEDFDDMZOQL-UHFFFAOYSA-N
- 1917700
MolClass #13059
TYEATTAFFFVPHE-UHFFFAOYSA-N
- 1917701
MolClass #13060
NYFITVVEDVQCQD-UHFFFAOYSA-N
- 1917702
MolClass #13061
NREAJZQUFAGURI-UHFFFAOYSA-N
- 1917703
MolClass #13062
VTIHBABYZWAUFQ-UHFFFAOYSA-N
- 1917704
MolClass #13063
HOELDDRHIADZNV-UHFFFAOYSA-N
- 1917705
MolClass #13064
LUKUOCAHHNULJI-UHFFFAOYSA-N
- 1507428
MolClass #13065
CIYJYQNDEGEPBQ-UHFFFAOYSA-N
- 1074133
MolClass #13066
AIXZBGVLNVRQSS-UHFFFAOYSA-N
- 1917714
MolClass #13067
QRMCWKAQTCQJPD-PXLXIMEGSA-N
- 1917721
MolClass #13068
FXYFDLSNCLJHMY-UHFFFAOYSA-N
- 1388273
MolClass #13069
URZLGZSGBBNZCT-UHFFFAOYSA-N
- 1917753
MolClass #13070
CNUWYNDMLFVRBU-UHFFFAOYSA-N
- 1917754
MolClass #13071
PEQYZILRIJSUBO-UHFFFAOYSA-N
- 1162294
MolClass #13072
CWKMPZOEUOYQAU-UHFFFAOYSA-N
- 1515525
MolClass #13073
NZVASBWFMHOING-UHFFFAOYSA-N
- 1917773
MolClass #13074
LMOAIEALVJHKLY-UHFFFAOYSA-N
- 1917779
MolClass #13075
RYPCZPGOOPCWFI-UHFFFAOYSA-N
- 1917797
MolClass #13076
NRGFKRKCPHRNLS-BOPFTXTBSA-N
- 1917801
MolClass #13077
VCWQHAMYKPRLBC-UHFFFAOYSA-N
- 1917814
MolClass #13078
NERFNEXXWTXEMR-ZHACJKMWSA-N
- 1917822
MolClass #13079
DXEPOHWWGHUDOM-XKZIYDEJSA-N
- 1917832
MolClass #13080
SRUCTOBEZMNROB-JQIJEIRASA-N
- 1776738
MolClass #13081
RDNHEFWZOKNXKM-DHZHZOJOSA-N
- 1917841
MolClass #13082
WWVCWCBSLQOPOD-UHFFFAOYSA-N
- 1776695
MolClass #13083
RENWKKKXUKFSRO-UHFFFAOYSA-N
- 1917853
MolClass #13084
LAPVFTFXZOTVLT-UHFFFAOYSA-N
- 1917858
MolClass #13085
DJNOIDGQRCWGSS-UHFFFAOYSA-N
- 1581400
MolClass #13086
HUEAREQFYNUIEN-UHFFFAOYSA-N
- 1917867
MolClass #13087
- 1440954
MolClass #13088
HGLLDOSKHNEXEP-UHFFFAOYSA-N
- 1917890
MolClass #13089
GOGWENNUTYFINM-UHFFFAOYSA-N
- 1917892
MolClass #13090
WYGGAYBFDHIUKE-QBDURLHVSA-N
- 1917894
MolClass #13091
LVMAUJADNISQOJ-LICLKQGHSA-N
- 1917913
MolClass #13092
LUGYDRGZQHGHLA-OUKQBFOZSA-N
- 1917924
MolClass #13093
DUGRIXCALFSETO-OIKHISIKSA-N
- 1917927
MolClass #13094
OVJSCZJTTHQRKD-UHFFFAOYSA-N
- 1917928
MolClass #13095
- 1723668
MolClass #13096
NLWWHMRHFRTAII-UHFFFAOYSA-N
- 1419299
MolClass #13097
VGNRJEZZQVQQGJ-UHFFFAOYSA-N
- 1917968
MolClass #13098
SDPFFPOZNWFUGT-XNTDXEJSSA-N
- 1402092
MolClass #13099
AGSGFBQWNNZFBC-UHFFFAOYSA-N
- 1917974
MolClass #13100
IYZREJCGMKCEDM-UUYOSTAYSA-N