Molecule directory
Explore structures, source datasets and saved model predictions for molecules registered in MolClass.
Search by molecule name, identifier or structure →- 28
MolClass #18701
GANBKJDEISWUIT-MHZLTWQESA-N
- 186
MolClass #18702
PYTGVMNMEXWEOU-SAGWHXFDSA-N
- 187
MolClass #18703
MIKVZEXDFZNDDM-UHFFFAOYSA-N
- 91
MolClass #18704
IPTHFGHOMKEWQH-UHFFFAOYSA-N
- 189
MolClass #18705
- 190
MolClass #18706
HFUGBKCICWUZIJ-UHFFFAOYSA-N
- 33
MolClass #18707
YYPOIMPOOOIGKK-AZGAKELHSA-N
- 192
MolClass #18708
NAQFSYAUNUEGJW-ZBKIVJSUSA-N
- 191
MolClass #18709
PEKDAVMIZONKQG-UHFFFAOYSA-N
- 188
MolClass #18710
PRBJKHXLDVTRPN-DEOSSOPVSA-N
- 21
MolClass #18711
JKSINGQSEHHBRE-XUZZJYLKSA-N
- 196
MolClass #18712
JGVWSUQFPXEXQG-QFIPXVFZSA-N
- 27
MolClass #18713
USJGWEUTGWIYFM-XUZZJYLKSA-N
- 198
MolClass #18714
PDHPCIZPISXVIY-UHFFFAOYSA-N
- 31
MolClass #18715
MHPPKHXVUDPZHD-SANMLTNESA-N
- 200
MolClass #18716
YZSIAGKEGXROBU-NDIVSWGXSA-N
- 20
MolClass #18717
MFFFXQAPSOMTFZ-SANMLTNESA-N
- 202
MolClass #18718
MGZWBHMEJULRSQ-UHFFFAOYSA-N
- 203
MolClass #18719
JQVGJHNEIBMMEB-UHFFFAOYSA-N
- 9
MolClass #18720
TVTAJKGLDXBFHL-DEOSSOPVSA-N
- 205
MolClass #18721
VVEGUIWOXAUEON-UHFFFAOYSA-N
- 206
MolClass #18722
AATHXZYXWMKUFC-UHFFFAOYSA-N
- 18
MolClass #18723
CUARQYDGFXEYMP-NDEPHWFRSA-N
- 208
MolClass #18724
YOPWHYDRZBQVGI-UHFFFAOYSA-N
- 209
MolClass #18725
OBASJEFNGNHDOI-WREXNOFYSA-N
- 210
MolClass #18726
IJSYTGOVBUKMCA-UHFFFAOYSA-N
- 211
MolClass #18727
OELZFXTXLBIKDS-UHFFFAOYSA-N
- 212
MolClass #18728
PHRWYOPYWKQSEZ-UHFFFAOYSA-N
- 213
MolClass #18729
CQOZQGWBNYLNHN-UHFFFAOYSA-N
- 183
MolClass #18730
VVOPHBHXGCSLRY-VWLOTQADSA-N
- 215
MolClass #18731
ONJMNFUCIIFBMG-UHFFFAOYSA-N
- 216
MolClass #18732
WIQWZMXJFYDPOU-HMTLIYDFSA-N
- 72
MolClass #18733
YAQHMAIZFKGTCA-PMACEKPBSA-N
- 180
MolClass #18734
MJPRZTFMWHJGMK-FFILHAAMSA-N
- 219
MolClass #18735
RXJRFIVHHNTFRH-UHFFFAOYSA-N
- 220
MolClass #18736
OWGGEAOGNMENHX-WREXNOFYSA-N
- 214
MolClass #18737
NKYGNWLYMMANAH-UHFFFAOYSA-N
- 204
MolClass #18738
QFFMDDLLSWDZLE-UHFFFAOYSA-N
- 223
MolClass #18739
MXOTYVHJEKTERG-UHFFFAOYSA-N
- 197
MolClass #18740
JRSKVACFKLCUQH-SANMLTNESA-N
- 225
MolClass #18741
JUSFPWQJAFZMKW-UHFFFAOYSA-N
- 84
MolClass #18742
MHZINYCTUDNOIC-UHFFFAOYSA-N
- 193
MolClass #18743
BIFSMJUBKPDJOT-UHFFFAOYSA-N
- 218
MolClass #18744
WIOOFYGDQKSNAX-LLJLJFOGSA-N
- 224
MolClass #18745
IXWHJTMAJYJQMO-UHFFFAOYSA-N
- 226
MolClass #18746
FDJMGMDATQTKPB-UHFFFAOYSA-N
- 41
MolClass #18747
XBDQMKXVCMQVJT-SKCDSABHSA-N
- 86
MolClass #18748
UDNGFKCTOSJRRK-UHFFFAOYSA-N
- 233
MolClass #18749
RAJYQBFEAGRQII-UHFFFAOYSA-N
- 221
MolClass #18750
HSCBDDXIIWYLQX-UHFFFAOYSA-N
- 227
MolClass #18751
CSIQCPWSVYQHRQ-UHFFFAOYSA-N
- 236
MolClass #18752
WZGMMZMZDWBXJX-UHFFFAOYSA-N
- 237
MolClass #18753
RXOVUNCDSXLICR-PWRODBHTSA-N
- 238
MolClass #18754
LNTMHVQVPOJUBZ-UHFFFAOYSA-N
- 239
MolClass #18755
WLCMKUXPGMRAJK-UHFFFAOYSA-N
- 29
MolClass #18756
IQJHWUWPXHWKEW-DEOSSOPVSA-N
- 241
MolClass #18757
GLFJKCDLOVHCTQ-LBPRGKRZSA-N
- 242
MolClass #18758
PKGRTDLAVHDWGB-MRIGUKBISA-N
- 243
MolClass #18759
CLMQQNAHICZKBZ-UHFFFAOYSA-N
- 132
MolClass #18760
AIBPXPDBMXDYCO-QHCPKHFHSA-N
- 245
MolClass #18761
GJJHHZZKVHQJHG-UHFFFAOYSA-N
- 246
MolClass #18762
YSFQAQOMUCVTNV-NSHDSACASA-N
- 247
MolClass #18763
GRMUCAFYWSZSCW-UHFFFAOYSA-N
- 248
MolClass #18764
FXPLUZROHGTSCH-UHFFFAOYSA-N
- 249
MolClass #18765
APFKCRTWNKCURW-UHFFFAOYSA-N
- 250
MolClass #18766
DHSRDOQTUZDZAQ-UHFFFAOYSA-N
- 199
MolClass #18767
RMSYZZDLBCSCEN-QHCPKHFHSA-N
- 252
MolClass #18768
SAIGVFQIHXWUBA-UHFFFAOYSA-N
- 253
MolClass #18769
MTZGOMUZAAZNCZ-UHFFFAOYSA-N
- 254
MolClass #18770
HLMOWVJEQDTZRJ-UHFFFAOYSA-N
- 232
MolClass #18771
LKDJLQOLTJSXLH-UHFFFAOYSA-N
- 256
MolClass #18772
JDXUSWQJCGTBLN-VAMGGRTRSA-N
- 257
MolClass #18773
KRSIBXQGZMDDMM-UHFFFAOYSA-N
- 258
MolClass #18774
NJWXFBCPKMPBSC-UHFFFAOYSA-N
- 260
MolClass #18775
DQRZUOURYRLPFC-UHFFFAOYSA-N
- 234
MolClass #18776
UUJINLCQAWPDGL-UHFFFAOYSA-N
- 83
MolClass #18777
WWDLLPDVKDJMAJ-UHFFFAOYSA-N
- 263
MolClass #18778
WQGMMPIKXADOQG-DAFXYXGESA-N
- 264
MolClass #18779
WXLILDXQUZIWFM-UHFFFAOYSA-N
- 265
MolClass #18780
AKWXGGSILJVTDG-UHFFFAOYSA-N
- 103
MolClass #18781
UJYPHTUHPMQTNN-UHFFFAOYSA-N
- 267
MolClass #18782
VUINSGHDSKJJIY-RNPORBBMSA-N
- 268
MolClass #18783
JKHFXJUXAQATEG-UHFFFAOYSA-N
- 269
MolClass #18784
RQWZWLHGJREPLG-DEOSSOPVSA-N
- 235
MolClass #18785
PKBJUALJQNSPHR-UHFFFAOYSA-N
- 271
MolClass #18786
RIOHVTVHJKWBSB-UHFFFAOYSA-N
- 162
MolClass #18787
UVESJXRHRDBPBC-UHFFFAOYSA-N
- 85
MolClass #18788
KFRIMCWQVDNABD-UHFFFAOYSA-N
- 274
MolClass #18789
GJDCYHGXHQTSHH-UHFFFAOYSA-N
- 275
MolClass #18790
GCPPMBSGYIARDA-UHFFFAOYSA-N
- 240
MolClass #18791
FTNAWDJDEPYSED-UHFFFAOYSA-N
- 277
MolClass #18792
YMECJEKTWCOEOU-FYJGNVAPSA-N
- 278
MolClass #18793
LWJIZXMIKKRPQT-UHFFFAOYSA-N
- 279
MolClass #18794
WVYVDJUDSZRKJH-UHFFFAOYSA-N
- 280
MolClass #18795
VFAFHVAMVOWFAO-UHFFFAOYSA-N
- 281
MolClass #18796
VWTMVSXTKISGHK-UHFFFAOYSA-N
- 282
MolClass #18797
MLPZODWGMLCMIG-UHFFFAOYSA-N
- 283
MolClass #18798
YAYFKCOQMKSBFP-UHFFFAOYSA-N
- 284
MolClass #18799
SPUAEQJRVQHWKF-NRAVZPKASA-N
- 285
MolClass #18800
KXJCWRLQLZOYIQ-UHFFFAOYSA-N