Molecule directory
Explore structures, source datasets and saved model predictions for molecules registered in MolClass.
Search by molecule name, identifier or structure →- 22410065
MolClass #46901
OXSWUBYDKPCXKR-UHFFFAOYSA-N
- 24819661
MolClass #46902
YZKGFQOBXIGBEF-UHFFFAOYSA-N
- 24829008
MolClass #46903
WIFXGNNGEACWED-CIAFOILYSA-N
- 24812686
MolClass #46904
PBMVZXBUWLFUMN-PDGQHHTCSA-N
- 24800605
MolClass #46905
GSOQTFCHZNBHNZ-UHFFFAOYSA-N
- 24818936
MolClass #46906
ZGSMAKABUUKIGZ-UHFFFAOYSA-N
- 4257815
MolClass #46907
AZDGRLSRUUOPJC-UHFFFAOYSA-N
- 17387281
MolClass #46908
ZHBZPEKEPADJDG-UHFFFAOYSA-N
- 4244151
MolClass #46909
LDIHBZDKBCKEIW-UHFFFAOYSA-N
- 24800277
MolClass #46910
HUGUDLIYXQPZHJ-UHFFFAOYSA-N
- 858327
MolClass #46911
KRZAZGHRYXVEHZ-UHFFFAOYSA-N
- 24819401
MolClass #46912
XNFKJUVCQMUGFF-UHFFFAOYSA-N
- 862639
MolClass #46913
NPLMDAHZTABXQO-UHFFFAOYSA-N
- 862795
MolClass #46914
BGMDJXVXRCLPGC-VRFXOJNMSA-N
- 24796495
MolClass #46915
GMZVKNOHFAPDBM-GZTJUZNOSA-N
- 24830750
MolClass #46916
NNINAVCNYBVJMR-UHFFFAOYSA-N
- 24800699
MolClass #46917
GYQWWBYIEFMCHC-HNNXBMFYSA-N
- 14735404
MolClass #46918
CPVVIKXJXDBAEW-UHFFFAOYSA-N
- 24821415
MolClass #46919
OMCSSEOQFCJAPA-UHFFFAOYSA-N
- 24787710
MolClass #46920
HGDYABGMCQSIGC-MDZDMXLPSA-N
- 17411585
MolClass #46921
HDDXEITYHLPDCF-UHFFFAOYSA-N
- 7968496
MolClass #46922
FXVMLSIPJAWNKQ-UHFFFAOYSA-N
- 17401620
MolClass #46923
PDRGDRQVKOPWFY-UHFFFAOYSA-N
- 17512024
MolClass #46924
ICWZERLCJBCQSA-GIJQJNRQSA-N
- 17407130
MolClass #46925
SBCMXNYFDTYMDB-UHFFFAOYSA-N
- 14746705
MolClass #46926
KHODOHYLNGOJEK-UHFFFAOYSA-N
- 24799383
MolClass #46927
QVTBXNXASSAIRN-UHFFFAOYSA-N
- 24798734
MolClass #46928
VKIASFLWSXDLFR-UHFFFAOYSA-N
- 24798937
MolClass #46929
MISZQUXHEZZVBD-UHFFFAOYSA-N
- 24830803
MolClass #46930
JZZOZDSYDXLBSN-UHFFFAOYSA-N
- 24816907
MolClass #46931
BJGCGXPXLXSBLO-UHFFFAOYSA-N
- 14721084
MolClass #46932
XVLWFCCWCKEZIM-UHFFFAOYSA-N
- 24797723
MolClass #46933
XEQULGDRLPZBKT-UHFFFAOYSA-N
- 3711854
MolClass #46934
BDBTWSUKYVIKSW-YRNVUSSQSA-N
- 7968467
MolClass #46935
OLJIECVPDXUUPP-UHFFFAOYSA-N
- 24830807
MolClass #46936
XYYOPOPJWYUCCA-UHFFFAOYSA-N
- 14733497
MolClass #46937
YVSKLLHMMFSCNG-UHFFFAOYSA-N
- 14739840
MolClass #46938
MYAXZVGAFGATAW-UHFFFAOYSA-N
- 14741517
MolClass #46939
HSPCCPQZARVXNF-UHFFFAOYSA-N
- 24826806
MolClass #46940
ORLONGCAALHLRI-KEBDBYFISA-N
- 17510871
MolClass #46941
XDLSZDRHOMMHOA-UHFFFAOYSA-N
- 14738247
MolClass #46942
JDYPBICWXWEBDT-UHFFFAOYSA-N
- 4243659
MolClass #46943
WABWAHVYIZLHOP-UHFFFAOYSA-N
- 7977296
MolClass #46944
ATHPZOHFMQWJKT-UHFFFAOYSA-N
- 14744994
MolClass #46945
IDKGGDCCFSDICC-UHFFFAOYSA-N
- 17410311
MolClass #46946
GRINWRRGVWZKHM-MDZDMXLPSA-N
- 4251990
MolClass #46947
IVCJAOMAFJTWNF-UHFFFAOYSA-N
- 17505259
MolClass #46948
YIYHOAXBKGQQAI-UHFFFAOYSA-N
- 24815835
MolClass #46949
CPJVWRDFFLMSBB-UHFFFAOYSA-N
- 4248180
MolClass #46950
XQMDJDMBZXVGDJ-UHFFFAOYSA-N
- 17511812
MolClass #46951
- 865781
MolClass #46952
- 3717507
MolClass #46953
SWVRAZZDIBWDKV-UHFFFAOYSA-N
- 4250515
MolClass #46954
NRKNGNXRGPJALL-UHFFFAOYSA-N
- 16953891
MolClass #46955
UEBZIQDINQDHFR-UHFFFAOYSA-N
- 7974729
MolClass #46956
YZPUIHVHPSUCHD-UHFFFAOYSA-N
- 4243785
MolClass #46957
IKLPRVWPPVURKJ-UHFFFAOYSA-N
- 17510203
MolClass #46958
IWUJEXSCYGXFPP-UHFFFAOYSA-N
- 24815858
MolClass #46959
TXJWWULSRLEBQY-UHFFFAOYSA-N
- 7976233
MolClass #46960
PBZZQWVRVASUDK-LFVJCYFKSA-N
- 17403418
MolClass #46961
FGSIUFVWXKGCRY-UHFFFAOYSA-N
- 17386440
MolClass #46962
FUFPPULQPVUEQM-UHFFFAOYSA-N
- 4250148
MolClass #46963
HCDWVCUANCUKLS-UHFFFAOYSA-N
- 4247398
MolClass #46964
GCWFBNYYHBVDKG-UHFFFAOYSA-N
- 849406
MolClass #46965
SWXUBSGSRROERZ-UHFFFAOYSA-N
- 14729964
MolClass #46966
JOUFDADZNMTYPZ-UHFFFAOYSA-N
- 860419
MolClass #46967
SMSGQEKNPSAXOZ-UHFFFAOYSA-N
- 858093
MolClass #46968
OMXHQPIRINPTBA-HTKRNXBHSA-N
- 849322
MolClass #46969
KVGOOJPGVRLSPG-UHFFFAOYSA-N
- 24785434
MolClass #46970
GWJWKHBCSBIDAQ-UHFFFAOYSA-N
- 24792070
MolClass #46971
XLWQJNOLXOZJFU-SSDVNMTOSA-N
- 24790851
MolClass #46972
VVGBAVHCIBTZMB-UHFFFAOYSA-N
- 24834348
MolClass #46973
GJRHGAJUWVQNSZ-BQYQJAHWSA-N
- 852492
MolClass #46974
GYFKSPFETMFMKC-UHFFFAOYSA-N
- 863505
MolClass #46975
YNDRAOWBGFVAOO-UHFFFAOYSA-N
- 3716889
MolClass #46976
NOODYJSWXKATKD-UHFFFAOYSA-N
- 863017
MolClass #46977
ITUGWJLIKSGELJ-UHFFFAOYSA-N
- 4240842
MolClass #46978
XALBMQVNOHJKGF-UHFFFAOYSA-N
- 863012
MolClass #46979
RCPKHEQPNNYQLA-UHFFFAOYSA-N
- 16953613
MolClass #46980
ZIGOKIBQBDODBD-UHFFFAOYSA-N
- 863005
MolClass #46981
SLYCLRHHEHAUNQ-UHFFFAOYSA-N
- 7965608
MolClass #46982
FDOCNEHIXHHBSD-UHFFFAOYSA-N
- 24823867
MolClass #46983
VIQYCATYUJQXPX-UHFFFAOYSA-N
- 22415656
MolClass #46984
ADCHMPPQFIRJRA-OUKQBFOZSA-N
- 24783500
MolClass #46985
QEFVVOXLUWMQJF-UHFFFAOYSA-N
- 14732117
MolClass #46986
XVMWYOXBAXDISJ-UHFFFAOYSA-N
- 24824093
MolClass #46987
PTOJXIKSKSASRB-UHFFFAOYSA-O
- 862544
MolClass #46988
NJNNVFVACLZJME-UHFFFAOYSA-N
- 24796405
MolClass #46989
CRQLNUKMODHJOX-UHFFFAOYSA-N
- 24832182
MolClass #46990
OEBCGWYBBOOAIV-UHFFFAOYSA-N
- 24816999
MolClass #46991
RWRWIICNMOKBIQ-UHFFFAOYSA-N
- 24797027
MolClass #46992
VNUHGJFWJAIONI-UHFFFAOYSA-N
- 3713224
MolClass #46993
BNRJAZHWYUDYMY-UHFFFAOYSA-N
- 14741150
MolClass #46994
KILGTLYTTPXMDA-UHFFFAOYSA-N
- 4241913
MolClass #46995
ZGFQXKNJHVDQDT-UHFFFAOYSA-N
- 24834004
MolClass #46996
BWJVUHDRBLGESR-YTMVLYRLSA-N
- 24833972
MolClass #46997
IGTBJBDWOLNHBV-DBESADCWSA-N
- 17407420
MolClass #46998
JNTGSIIBFRFFDE-UHFFFAOYSA-N
- 24812444
MolClass #46999
WFMOZPIDZMMVNP-UHFFFAOYSA-N
- 14742343
MolClass #47000
RJUHANIGRUFSBE-UHFFFAOYSA-N