Molecule directory
Explore structures, source datasets and saved model predictions for molecules registered in MolClass.
Search by molecule name, identifier or structure →- 1346867
MolClass #17001
- 1915135
MolClass #17002
VIDGNEAGPCPFDI-UHFFFAOYSA-N
- 2063384
MolClass #17003
MLGCGZNEHULXEA-UHFFFAOYSA-N
- 1986380
MolClass #17004
DPELXVZRYYSDJE-UHFFFAOYSA-N
- 3123385
MolClass #17005
JLXOODUTAYUFCP-UHFFFAOYSA-N
- 2067577
MolClass #17006
VUMJGPZMYNLNHL-SFQUDFHCSA-N
- 1916237
MolClass #17007
RIGOJJCZJYQMBV-DTQAZKPQSA-N
- 1910307
MolClass #17008
DKCXBONSLYYOJJ-LICLKQGHSA-N
- 2060813
MolClass #17009
- 1477575
MolClass #17010
ISOZOCYRLMHBJM-UHFFFAOYSA-N
- 1312006
MolClass #17011
VVFWZKAIVBLWIP-UHFFFAOYSA-N
- 3122846
MolClass #17012
HCRCZLNQDXPWHO-UHFFFAOYSA-N
- 2063489
MolClass #17013
IXVRQSPMRBIWPG-UHFFFAOYSA-N
- 1907969
MolClass #17014
AOUYYCNJLIGUTK-KAMYIIQDSA-N
- 3120816
MolClass #17015
ACUJNGCBBFGNMQ-UHFFFAOYSA-N
- 1562483
MolClass #17016
FSFNIMPBTIXCSH-UHFFFAOYSA-N
- 1137376
MolClass #17017
BRCTWXMOYNLOJQ-UHFFFAOYSA-N
- 1327244
MolClass #17018
SELFMZFUAAIBEZ-UHFFFAOYSA-N
- 1911773
MolClass #17019
WEQCGUNOIZXTOQ-UHFFFAOYSA-N
- 1985683
MolClass #17020
ULZRSQREYWUMAP-UHFFFAOYSA-N
- 1908806
MolClass #17021
- 1927091
MolClass #17022
NUTLVDNMXHSGAY-UHFFFAOYSA-N
- 1558123
MolClass #17023
HITDFGXWQILASY-UHFFFAOYSA-N
- 1975243
MolClass #17024
YXJZOUAFLMXTTM-UHFFFAOYSA-N
- 1981894
MolClass #17025
JDKKNZCTQZVUAU-UHFFFAOYSA-N
- 1735517
MolClass #17026
IWUMSIWXCHHAQK-UHFFFAOYSA-N
- 1713342
MolClass #17027
HEZWCUCDPHMYOZ-UHFFFAOYSA-N
- 1153052
MolClass #17028
- 3034456
MolClass #17029
CJCJISDKRMHNCT-UHFFFAOYSA-N
- 1165432
MolClass #17030
CDWDBQTWOQKRDS-UHFFFAOYSA-N
- 3022392
MolClass #17031
KCFAAGAGYIRJOJ-UHFFFAOYSA-N
- 2061514
MolClass #17032
- 3043442
MolClass #17033
JJJROOMRINYFJV-UHFFFAOYSA-N
- 1922345
MolClass #17034
CYJRBEVGCWBRJN-KNTRCKAVSA-N
- 3122574
MolClass #17035
RQIPKIYNBOLGMT-UHFFFAOYSA-N
- 1407405
MolClass #17036
SFVMCOSLBUNLOC-UHFFFAOYSA-N
- 1947371
MolClass #17037
OELUWCNENVJYDI-UHFFFAOYSA-N
- 1123814
MolClass #17038
RFLWGSKFCPCEHC-UHFFFAOYSA-N
- 2069552
MolClass #17039
BYACMUXIPOWEAM-UHFFFAOYSA-N
- 1611665
MolClass #17040
GCQDXOJZFVLHON-UHFFFAOYSA-N
- 1983288
MolClass #17041
DSKZRYRDERKMLX-UHFFFAOYSA-N
- 1942731
MolClass #17042
UZDHGVRQECLHEU-UHFFFAOYSA-N
- 1941893
MolClass #17043
AXIWWLGRJLSXHG-UHFFFAOYSA-N
- 3117973
MolClass #17044
PGZCJOPTDHWYES-MNLRITNHSA-N
- 2060907
MolClass #17045
- 1988815
MolClass #17046
WLCNTJZFCBVJGO-UHFFFAOYSA-N
- 1170318
MolClass #17047
OGXOKUCEMQCDCB-UHFFFAOYSA-N
- 1122737
MolClass #17048
WHMDSTSMZBRAOK-UHFFFAOYSA-N
- 1228741
MolClass #17049
TVMRUIKOSLPSKE-UHFFFAOYSA-N
- 1734767
MolClass #17050
JLLCYNCQROAMOB-UHFFFAOYSA-N
- 1911127
MolClass #17051
ZQIXZHFHERZVTI-BOPFTXTBSA-N
- 1971454
MolClass #17052
DUXRWCAYEDSCKM-UHFFFAOYSA-N
- 3119224
MolClass #17053
CTDNYFUVTGMEON-PVKCIBLZSA-N
- 1965542
MolClass #17054
CELDRNWFTNFGAD-UHFFFAOYSA-N
- 1938508
MolClass #17055
WHHSBAJTNIGTMZ-RQZCQDPDSA-N
- 1477422
MolClass #17056
- 1555617
MolClass #17057
UPMRWVBGFOAYOH-UHFFFAOYSA-N
- 1911231
MolClass #17058
- 2061317
MolClass #17059
JTPQSXJEXQMDHN-UHFFFAOYSA-N
- 1979743
MolClass #17060
HPTDRJQCKAKEQS-UHFFFAOYSA-N
- 1926347
MolClass #17061
FBDQKRAWGRTSAE-PGACXJNKSA-N
- 3024624
MolClass #17062
OLMLEIUYSMYMLH-UHFFFAOYSA-N
- 2069258
MolClass #17063
WDHLJEOPUWGKKG-UHFFFAOYSA-N
- 1562226
MolClass #17064
JIMCKQMOIJWJJV-UHFFFAOYSA-N
- 1910081
MolClass #17065
YKFFROOBAVJFJS-LSHDLFTRSA-N
- 1924170
MolClass #17066
DKGCVWDRBBGINU-UHFFFAOYSA-N
- 2069925
MolClass #17067
JPRCJLLACYKUFT-UHFFFAOYSA-N
- 1965312
MolClass #17068
LDNYSRWWEVOTRP-UHFFFAOYSA-N
- 3120241
MolClass #17069
MPPHFDOJUAKVKQ-UHFFFAOYSA-N
- 1205986
MolClass #17070
ICXADQHBWHLSCI-UHFFFAOYSA-N
- 2137066
MolClass #17071
XVWBNFAOXIQCBO-WRHMHNIJSA-N
- 1909911
MolClass #17072
YVCIRWXAYDOZNO-FOWTUZBSSA-N
- 1984489
MolClass #17073
KVFXMYSTVLIWOY-UHFFFAOYSA-N
- 1934718
MolClass #17074
VGCYMHSDDYOPIT-KPKJPENVSA-N
- 1947532
MolClass #17075
YUYIGSGZNJBLDR-GQCTYLIASA-N
- 1390700
MolClass #17076
LPSDOIZRJUFXDH-UHFFFAOYSA-N
- 1943856
MolClass #17077
ABXVTBBJEWIKOB-UHFFFAOYSA-N
- 1698103
MolClass #17078
BXIZJGZAEAKYFL-UHFFFAOYSA-N
- 1261080
MolClass #17079
- 1920163
MolClass #17080
AMOUXUIXXQFHJR-UHFFFAOYSA-N
- 1989345
MolClass #17081
GHHKQGBWJHGJPB-UHFFFAOYSA-N
- 1448035
MolClass #17082
YLLYEDXFZYPVQE-UHFFFAOYSA-N
- 1984730
MolClass #17083
UEIXRXFQBGVSNY-UHFFFAOYSA-N
- 1942389
MolClass #17084
- 1640925
MolClass #17085
ITTBNSBANZGQEU-UHFFFAOYSA-N
- 1948777
MolClass #17086
LAIKYDPRNRWNIO-XFXZXTDPSA-N
- 1940175
MolClass #17087
PSWKQXBUSXIHHN-UHFFFAOYSA-N
- 1391033
MolClass #17088
VUIKXOMLUBSZMJ-UHFFFAOYSA-N
- 1456243
MolClass #17089
WQZAYICHHZIOBZ-UHFFFAOYSA-N
- 1933918
MolClass #17090
ALEALBXSODEZNS-ODCIPOBUSA-N
- 3041880
MolClass #17091
JPZQOOGPDYPVPJ-UHFFFAOYSA-N
- 3027246
MolClass #17092
FEHINXUSBDEUSC-UHFFFAOYSA-N
- 1278751
MolClass #17093
WSQGLYYNQDZURT-UHFFFAOYSA-N
- 1922878
MolClass #17094
KXJYBXUIIIFORF-VIZOYTHASA-N
- 3125398
MolClass #17095
- 1913301
MolClass #17096
TWEWBQDHCIZXBC-UHFFFAOYSA-N
- 1921073
MolClass #17097
- 1951292
MolClass #17098
- 1918401
MolClass #17099
OVPIJZXBDOXISU-UHFFFAOYSA-N
- 1654382
MolClass #17100
HJKRDCAOKQDPES-UHFFFAOYSA-N