Molecule directory
Explore structures, source datasets and saved model predictions for molecules registered in MolClass.
Search by molecule name, identifier or structure →- 24794471
MolClass #36101
SOJDPCBGJCYKCJ-UHFFFAOYSA-N
- 866029
MolClass #36102
TWUFWCQFIWNORU-UHFFFAOYSA-N
- 858456
MolClass #36103
PERIKTJXFIUHBJ-UHFFFAOYSA-N
- 14738544
MolClass #36104
HNIZQAITQLHEMI-ACCUITESSA-N
- 3715374
MolClass #36105
RCNKGMDBJGCTNU-UHFFFAOYSA-N
- 4240660
MolClass #36106
UPCQNBINKKGCHK-UHFFFAOYSA-N
- 3714708
MolClass #36107
XTXZBBGTJRYMQC-UHFFFAOYSA-N
- 4245321
MolClass #36108
- 22409815
MolClass #36109
- 22402085
MolClass #36110
CDYLYEWVJPCVFY-UHFFFAOYSA-N
- 24820346
MolClass #36111
JAPNXZQVJCAXIF-UHFFFAOYSA-N
- 24799680
MolClass #36112
PENQDTYBGPXENA-UHFFFAOYSA-N
- 864785
MolClass #36113
DCNZODDMKOTPHQ-UHFFFAOYSA-N
- 855989
MolClass #36114
KPJZHOPZRAFDTN-ZRGWGRIASA-N
- 24799708
MolClass #36115
GLOYLCYMNAZILV-UHFFFAOYSA-N
- 14730073
MolClass #36116
GTIHJSDCSFRDLJ-DEAVOCJISA-N
- 24799086
MolClass #36117
NJOCPEWZAWYBAN-UHFFFAOYSA-N
- 24799685
MolClass #36118
XCNMSOSIQQZJNR-UHFFFAOYSA-N
- 24820484
MolClass #36119
HTQPNFPOZPISAD-UHFFFAOYSA-N
- 843700
MolClass #36120
- 24783021
MolClass #36121
RPHMAQXEFYASJZ-UHFFFAOYSA-N
- 24786137
MolClass #36122
GXTDMBWAWOCPGD-JTJYXVOQSA-N
- 24819818
MolClass #36123
LSOQEMDMIIKUNI-UHFFFAOYSA-N
- 851559
MolClass #36124
GIGFIWJRTMBSRP-UHFFFAOYSA-N
- 24782229
MolClass #36125
- 24809950
MolClass #36126
GSTBIPUTOBWTEH-UHFFFAOYSA-N
- 14744341
MolClass #36127
RFGCWJZOFBNOEK-UHFFFAOYSA-N
- 4241809
MolClass #36128
ZKCIKWRVEIMWLY-UHFFFAOYSA-N
- 14728206
MolClass #36129
- 24707893
MolClass #36130
NPWJFBWILTYILH-JZHZUCMVSA-N
- 14742211
MolClass #36131
UROAGBRHXNLTPV-UHFFFAOYSA-N
- 7976160
MolClass #36132
BODCKPILFGWHGC-UHFFFAOYSA-N
- 22405487
MolClass #36133
ALEQYOXVXJKFOM-MKKAWSSWSA-N
- 14738600
MolClass #36134
WIKPOVHXIIIGLU-UHFFFAOYSA-N
- 24798283
MolClass #36135
APLSVTZJVMTITH-UHFFFAOYSA-N
- 17406963
MolClass #36136
- 3715064
MolClass #36137
- 24708162
MolClass #36138
- 14726522
MolClass #36139
SDAWYSHISYKCRU-PKNBQFBNSA-N
- 4257186
MolClass #36140
SYNCKNPNXYZSMW-UHFFFAOYSA-N
- 24816434
MolClass #36141
UBWONUIBYANXMY-UHFFFAOYSA-N
- 857583
MolClass #36142
- 7967572
MolClass #36143
BXISOPKQRATYMT-UHFFFAOYSA-N
- 24814419
MolClass #36144
NUOQPJBWTMYGPF-UHFFFAOYSA-N
- 22402177
MolClass #36145
UJFZFQBBZUDIIV-UHFFFAOYSA-N
- 22414266
MolClass #36146
- 24795712
MolClass #36147
IOSBDCUCLGSGRX-UHFFFAOYSA-N
- 24811642
MolClass #36148
UXPILKKRQRFDSF-UHFFFAOYSA-N
- 3714842
MolClass #36149
ZVXPPRPCRWUYHG-UHFFFAOYSA-N
- 24823567
MolClass #36150
LKKSPQLDRZTINU-UHFFFAOYSA-N
- 24816162
MolClass #36151
DNNAXCFXMCTBGR-UHFFFAOYSA-N
- 24824432
MolClass #36152
BQBSUGPNZXJKEH-UHFFFAOYSA-N
- 844427
MolClass #36153
UOPUWDHABWQXES-UHFFFAOYSA-N
- 24807833
MolClass #36154
LWHJSIZBXGUMTJ-UHFFFAOYSA-P
- 17505160
MolClass #36155
JAJHGXPHZRGSGC-GIDUJCDVSA-N
- 24824650
MolClass #36156
NAIJONGAIFSJQA-AATRIKPKSA-N
- 24809341
MolClass #36157
RLWZHDCIBUFLMD-UHFFFAOYSA-N
- 24824826
MolClass #36158
BYYFKAJSTZBQDN-AATRIKPKSA-N
- 17512094
MolClass #36159
LFIDGHPVULHBNN-UHFFFAOYSA-N
- 3714461
MolClass #36160
IUDBCJKXQPNARQ-UHFFFAOYSA-N
- 24804810
MolClass #36161
- 24818833
MolClass #36162
XITROMIMEXHPLF-UHFFFAOYSA-N
- 24787147
MolClass #36163
- 4249832
MolClass #36164
REWLCLBPTOHABV-UHFFFAOYSA-N
- 24818893
MolClass #36165
VDTAJGPQQFUGEQ-UHFFFAOYSA-N
- 14737033
MolClass #36166
AEYMVOFHFPTTBG-UHFFFAOYSA-N
- 4255549
MolClass #36167
JJZJIGWCKSMVGL-UHFFFAOYSA-N
- 24780504
MolClass #36168
- 22411655
MolClass #36169
CUZVPTYKIQMJDT-UHFFFAOYSA-N
- 859184
MolClass #36170
GIWGUGKYSSLEOP-UHFFFAOYSA-N
- 24809538
MolClass #36171
- 24837114
MolClass #36172
PZMKGWRBZNOIPQ-UHFFFAOYSA-N
- 14728215
MolClass #36173
- 24781269
MolClass #36174
LHSGEUXVJGRPCN-UHFFFAOYSA-N
- 848467
MolClass #36175
LPHTZKYBDDWSNH-UHFFFAOYSA-N
- 853511
MolClass #36176
QKGUBUDIMSHCKZ-UHFFFAOYSA-N
- 17504732
MolClass #36177
FPJQGFLUORYYPE-UHFFFAOYSA-N
- 4256463
MolClass #36178
QJDZRXLGQGLJIY-UHFFFAOYSA-N
- 3712525
MolClass #36179
QOIJWQJIXFOXCA-UHFFFAOYSA-N
- 24785364
MolClass #36180
IZDLYSSIMJSFRF-UHFFFAOYSA-N
- 17514672
MolClass #36181
BFTMTYKOMDYUDQ-UHFFFAOYSA-N
- 4262943
MolClass #36182
AHCRTDCKCIZXLI-UHFFFAOYSA-N
- 24811376
MolClass #36183
ASTAOQLBUXWNNV-FNORWQNLSA-N
- 24828917
MolClass #36184
IQAITVLWGUFXPT-UHFFFAOYSA-N
- 24708114
MolClass #36185
HSMZIBZNUXZXPI-PYMCNQPYSA-N
- 24780845
MolClass #36186
ISQNUCJEUYXRGA-UHFFFAOYSA-N
- 14732078
MolClass #36187
RPFDXCAZIXFJHZ-UHFFFAOYSA-N
- 17504721
MolClass #36188
HXCGUCZXPFBNRD-DNLMCPORSA-N
- 4244917
MolClass #36189
RBQXDCBQVOXYDO-UHFFFAOYSA-N
- 4244582
MolClass #36190
VKGYRFKOXCRQAY-UHFFFAOYSA-N
- 24809279
MolClass #36191
NLZNOCHSXSJILW-UHFFFAOYSA-N
- 24807049
MolClass #36192
WQKHMRDEDLDTLX-UHFFFAOYSA-N
- 14737872
MolClass #36193
IVWWDZVJBBHMPU-UHFFFAOYSA-N
- 865182
MolClass #36194
- 24707965
MolClass #36195
JHBOCDVQCYXJHA-ZDUSSCGKSA-N
- 24814512
MolClass #36196
JPYGNUTTXKHNGF-UHFFFAOYSA-N
- 14743825
MolClass #36197
JODBYNRHXKIANW-FXBPSFAMSA-N
- 24804491
MolClass #36198
HGSATNLIHMOAMJ-UHFFFAOYSA-N
- 17511912
MolClass #36199
JISYQPSPCWWDMW-UHFFFAOYSA-N
- 4251777
MolClass #36200