Molecule directory
Explore structures, source datasets and saved model predictions for molecules registered in MolClass.
Search by molecule name, identifier or structure →- 3068667
MolClass #14101
FHJLPDMKLPPJFT-VBTAUBHQSA-N
- 3068375
MolClass #14102
DOGVZKYWCRDUMO-NPJWPSRESA-N
- 3067931
MolClass #14103
VNXBFYOGZXAAJM-IZEXYCQBSA-N
- 3186821
MolClass #14104
VMGYDZHLAMYRJU-ZEQKJWHPSA-N
- 3186823
MolClass #14105
HXXTWAHZOXPOPX-NVQXNPDNSA-N
- 3186824
MolClass #14106
PTDPBUOUPDFPAU-LEAFIULHSA-N
- 3186825
MolClass #14107
DOGVZKYWCRDUMO-PQGHEOKESA-N
- 3186827
MolClass #14108
YEOYFVNLECTHAH-IZEXYCQBSA-N
- 3067984
MolClass #14109
MCUMXBHPOQQCFP-OZXSUGGESA-N
- 3067987
MolClass #14110
MMNQYAKICDPODX-UHFFFAOYSA-N
- 2141091
MolClass #14111
LDAGKGOCDDGCLY-KTDJTCJASA-N
- 2141107
MolClass #14112
KFMHLEUGXDQKIW-KTDJTCJASA-N
- 2141123
MolClass #14113
LDAGKGOCDDGCLY-PEHRDTJFSA-N
- 2141133
MolClass #14114
KFMHLEUGXDQKIW-PEHRDTJFSA-N
- 2141141
MolClass #14115
CJTCNQDPNSJCFX-XTGMUSJUSA-N
- 3187198
MolClass #14116
LKCCLFIDLBZAHD-DFRVAGQYSA-N
- 3068202
MolClass #14117
HHRBRNSLVXZTHS-VAVYLYDRSA-N
- 2141152
MolClass #14118
VACCNIRAJOIDQS-RVKOZMQOSA-N
- 2141155
MolClass #14119
IVSDCONRCDXHGW-KTDJTCJASA-N
- 2141157
MolClass #14120
CFGLDVXLFXOGNR-ZVELBVITSA-N
- 3187002
MolClass #14121
NTNXBZOILLRXHV-PDDLMNHVSA-N
- 2141167
MolClass #14122
KPOYZYGZZDGGAE-JCHZIMIVSA-N
- 3068115
MolClass #14123
NTNXBZOILLRXHV-YZNIXAGQSA-N
- 2141178
MolClass #14124
YCHOQACEUCMVIS-WLCXLKLGSA-N
- 2141179
MolClass #14125
GIPTZBUNSGIOGU-KUVDWFRWSA-N
- 3187530
MolClass #14126
ZKTVXWBLXFTQOH-PDDLMNHVSA-N
- 2141189
MolClass #14127
UJHDTDRJPOGPNT-MJPOSUMMSA-N
- 3186744
MolClass #14128
ZKTVXWBLXFTQOH-YZNIXAGQSA-N
- 3068002
MolClass #14129
KVDQICFBKMFZAV-IZEXYCQBSA-N
- 2141218
MolClass #14130
UWJNEXMFWQHPDA-AKLGMDLCSA-N
- 3068477
MolClass #14131
KVDQICFBKMFZAV-GRKNLSHJSA-N
- 2141221
MolClass #14132
BTFQBLQRGQKFPM-HMFYUPBTSA-N
- 3187534
MolClass #14133
FMOSHIVCPVHAAN-GRKNLSHJSA-N
- 2141168
MolClass #14134
SHXVWLYRSQNAIB-PYKWJCDWSA-N
- 3052652
MolClass #14135
FIMRYOBWDKQKQA-YRODRHKCSA-N
- 3176202
MolClass #14136
USFGJCYBCQZOPT-DXLYQEDASA-N
- 3187381
MolClass #14137
XXMCBHLYMKIVRH-AKGWNBJDSA-N
- 2141333
MolClass #14138
MMXPBZAPKOHUST-ZVELBVITSA-N
- 3187006
MolClass #14139
XXMCBHLYMKIVRH-IUDBTDONSA-N
- 2141331
MolClass #14140
QSMPKQQKIWIXCS-KTDJTCJASA-N
- 3052801
MolClass #14141
RDCHMPUVNQQTAJ-LZPKXPDASA-N
- 3176569
MolClass #14142
RDCHMPUVNQQTAJ-DCBOPVEOSA-N
- 3187455
MolClass #14143
STXFVULIPQXFMF-DITALETJSA-N
- 2141414
MolClass #14144
OBZYJYSLRVCLDG-QNJHUHSPSA-N
- 2141416
MolClass #14145
MPGGYALRQFNNSP-QKUPMJNASA-N
- 2141423
MolClass #14146
ZABISKKNPZPGLG-ZAEJFRQQSA-N
- 2141431
MolClass #14147
AIOFEHDQEVQEAT-ZYZITPBBSA-N
- 3068013
MolClass #14148
STXFVULIPQXFMF-LXANVCGNSA-N
- 3186301
MolClass #14149
CXFIKYFKDKKDCM-JHIJRVFASA-N
- 2141507
MolClass #14150
IVSDCONRCDXHGW-PEHRDTJFSA-N
- 2141509
MolClass #14151
CFGLDVXLFXOGNR-VKRLYFPISA-N
- 3068370
MolClass #14152
CXFIKYFKDKKDCM-VKFYKEIUSA-N
- 3068180
MolClass #14153
IHYHSHHGQALIAC-DHIFEGFHSA-N
- 2141519
MolClass #14154
KPOYZYGZZDGGAE-YPLGXPHSSA-N
- 2141520
MolClass #14155
SHXVWLYRSQNAIB-DWNAWVCDSA-N
- 3186447
MolClass #14156
IHYHSHHGQALIAC-DLFZDVPBSA-N
- 2141328
MolClass #14157
GVBLZGZNVFMXFB-RVKOZMQOSA-N
- 3187284
MolClass #14158
RMPCIBMOLOGHCX-DLFZDVPBSA-N
- 2141548
MolClass #14159
QUFQQVZOEGMBEO-ZGRNHRAQSA-N
- 2141553
MolClass #14160
BYPZRYIYWNGHGD-FNPOHITPSA-N
- 3186516
MolClass #14161
YSLYHFPMPBKRNV-FPRUPVGPSA-N
- 2141570
MolClass #14162
UWJNEXMFWQHPDA-UOGMBTEBSA-N
- 3187094
MolClass #14163
YSLYHFPMPBKRNV-IPSRBREOSA-N
- 2141575
MolClass #14164
XJZVBYKZNHGSBX-ZGRNHRAQSA-N
- 3187203
MolClass #14165
YBXIWBCNZGFPKO-CYTLCNBWSA-N
- 3187096
MolClass #14166
NESQAINAYMBFIW-RWMHTRQUSA-N
- 2141680
MolClass #14167
GVBLZGZNVFMXFB-KIBNOENRSA-N
- 3068058
MolClass #14168
NESQAINAYMBFIW-DSNYNDKXSA-N
- 2141683
MolClass #14169
QSMPKQQKIWIXCS-PEHRDTJFSA-N
- 2141685
MolClass #14170
MMXPBZAPKOHUST-VKRLYFPISA-N
- 2141515
MolClass #14171
DQWDPZCYIFXXDM-PPYKXXGHSA-N
- 2141159
MolClass #14172
RKZHAKBSCCRTSX-RXUISWLBSA-N
- 2141511
MolClass #14173
RKZHAKBSCCRTSX-FAPFDUBTSA-N
- 2141749
MolClass #14174
GPNPAQWJFMPKFD-RGGJFFAYSA-N
- 2141766
MolClass #14175
OBZYJYSLRVCLDG-IQKXDFEWSA-N
- 2141768
MolClass #14176
MPGGYALRQFNNSP-ZSRDLQDUSA-N
- 2141856
MolClass #14177
JGWKYLUYSJMWIT-UNEYRYTCSA-N
- 2141861
MolClass #14178
SGHRSEPOJUNLBC-OKZLZZNTSA-N
- 2141863
MolClass #14179
OSEUTBXXZUDHEF-BCKOHZDJSA-N
- 2141900
MolClass #14180
JGWKYLUYSJMWIT-XTGMUSJUSA-N
- 2141905
MolClass #14181
SGHRSEPOJUNLBC-KJQJFSODSA-N
- 2141907
MolClass #14182
OSEUTBXXZUDHEF-DXYLJOCUSA-N
- 3052581
MolClass #14183
NWRSATNXDKVGQS-FECNJBKYSA-N
- 3176047
MolClass #14184
NWRSATNXDKVGQS-MNNCGDCDSA-N
- 2141150
MolClass #14185
GQTSDHBBWOAFCN-LXWWIJTGSA-N
- 2141502
MolClass #14186
GQTSDHBBWOAFCN-KPZMLMJYSA-N
- 2141216
MolClass #14187
RPSYOLVNQXGDNH-BCKOHZDJSA-N
- 2141568
MolClass #14188
RPSYOLVNQXGDNH-DXYLJOCUSA-N
- 2141687
MolClass #14189
WOWIUVPMWBOFFG-FAPFDUBTSA-N
- 2141335
MolClass #14190
WOWIUVPMWBOFFG-RXUISWLBSA-N
- 2141190
MolClass #14191
ORAAQTGQDDIZRM-XDWJUNQNSA-N
- 2141542
MolClass #14192
ORAAQTGQDDIZRM-VZJWQCSCSA-N
- 2141366
MolClass #14193
SIAMCPDTZJAYRI-XDWJUNQNSA-N
- 2141973
MolClass #14194
XWAXQDFDXYHUCQ-IEGQRRDXSA-N
- 3052592
MolClass #14195
AOSSFKAYTRVVAO-XFAFEJABSA-N
- 2141678
MolClass #14196
IFLOTBCIWULJHG-KPZMLMJYSA-N
- 2141326
MolClass #14197
IFLOTBCIWULJHG-LXWWIJTGSA-N
- 2141709
MolClass #14198
NTZFBJLGKCEBME-UOGMBTEBSA-N
- 2141357
MolClass #14199
NTZFBJLGKCEBME-AKLGMDLCSA-N
- 2141571
MolClass #14200
MGFKQBVEOAZMQK-NEXMHZLLSA-N