Molecule directory
Explore structures, source datasets and saved model predictions for molecules registered in MolClass.
Search by molecule name, identifier or structure →- 24797586
MolClass #46201
OZAPGSHYLRMKFD-UHFFFAOYSA-N
- 24797700
MolClass #46202
JBGPIEUSMSSQRP-UHFFFAOYSA-N
- 17515089
MolClass #46203
PDLJHTDPXHISGM-UHFFFAOYSA-N
- 14735833
MolClass #46204
YWENETATHBSFCQ-UHFFFAOYSA-N
- 22413935
MolClass #46205
HSEHKBPZCDLUHZ-LCYFTJDESA-N
- 14735775
MolClass #46206
QMHRHIGZPPXSDO-UHFFFAOYSA-N
- 14719037
MolClass #46207
KEWJCBHFKNBFCA-UHFFFAOYSA-N
- 24825911
MolClass #46208
BYDDDLOHMINCJR-UHFFFAOYSA-N
- 17411345
MolClass #46209
AIKKJZVAUWDTKS-UHFFFAOYSA-N
- 3716540
MolClass #46210
JHAJBCBHPAHTOM-UHFFFAOYSA-N
- 24816995
MolClass #46211
MDFBXDMDZYCXIT-UHFFFAOYSA-N
- 14738026
MolClass #46212
WXUYFMQIXXKENB-UHFFFAOYSA-N
- 24786555
MolClass #46213
MLSSEIYJTVDKTK-UHFFFAOYSA-N
- 24805557
MolClass #46214
JYEFXNUTHWKKGY-UHFFFAOYSA-N
- 24793682
MolClass #46215
CQQIFBDVEGXOCY-UHFFFAOYSA-N
- 852038
MolClass #46216
HSRKTALGGYHIPX-UHFFFAOYSA-N
- 22403960
MolClass #46217
KOHMILAYNCXYHB-UHFFFAOYSA-N
- 24834213
MolClass #46218
NFUYWFZTLUOGQE-UHFFFAOYSA-N
- 17504511
MolClass #46219
VCAAJAQNRPDMCW-ZMOGYAJESA-N
- 24798173
MolClass #46220
QKZXSIUKBHOWJA-UHFFFAOYSA-N
- 4264723
MolClass #46221
YGLQDMONWCTOMG-UHFFFAOYSA-N
- 24821354
MolClass #46222
NHYDBJFGZCQFEO-UHFFFAOYSA-N
- 3711723
MolClass #46223
ZBYYITGKQLENSW-UHFFFAOYSA-N
- 14727646
MolClass #46224
UWZVXKHMRWPICM-UHFFFAOYSA-N
- 4258816
MolClass #46225
- 24806278
MolClass #46226
QAVUEQKULBQSLB-UHFFFAOYSA-N
- 24788200
MolClass #46227
ASMUJXNKLWUFRB-UHFFFAOYSA-N
- 24817887
MolClass #46228
XWHLGXSEXFEBER-UHFFFAOYSA-N
- 4242260
MolClass #46229
CMIWOVFMNRJPIS-UHFFFAOYSA-N
- 24818453
MolClass #46230
CZHFZTNMDDBJRB-NTMALXAHSA-N
- 24825751
MolClass #46231
KOKZVDDXZIBPED-LVZFUZTISA-N
- 842908
MolClass #46232
- 863715
MolClass #46233
IYNXXGFYAYCLRB-UHFFFAOYSA-N
- 4243380
MolClass #46234
JHLLHZZTXIRHMN-UHFFFAOYSA-N
- 3717771
MolClass #46235
IXQZKZKVGGJPMS-UHFFFAOYSA-N
- 856559
MolClass #46236
IMTJFLKWZPDFQI-UHFFFAOYSA-N
- 24783045
MolClass #46237
XFEWQDLFVCMSHB-STZFKDTASA-N
- 24781885
MolClass #46238
ACBHCOBQCBCVEY-UHFFFAOYSA-N
- 7965415
MolClass #46239
DAMOOHCQZZFUPI-UHFFFAOYSA-N
- 22411776
MolClass #46240
VMWPFAJHZPXAMW-UHFFFAOYSA-N
- 22412057
MolClass #46241
VMSKOAGXQIHPAV-UHFFFAOYSA-N
- 17410826
MolClass #46242
FZNNGEJCSSMFMR-UHFFFAOYSA-N
- 14722081
MolClass #46243
NMMCECJORDDLGS-UHFFFAOYSA-N
- 14733063
MolClass #46244
CMLBJQCMHSAAJP-UHFFFAOYSA-N
- 22412936
MolClass #46245
GHVJEAIVACAXIK-UHFFFAOYSA-N
- 14727961
MolClass #46246
JDQQHYBAWBPWFX-UHFFFAOYSA-N
- 14740235
MolClass #46247
XVCGIHOMHJNGCN-UHFFFAOYSA-N
- 22404660
MolClass #46248
GWNDPSWCXFXQDZ-UHFFFAOYSA-N
- 22409588
MolClass #46249
QMQHUSDEKLNRCH-UHFFFAOYSA-N
- 17508735
MolClass #46250
MJKRXRRUOWINKG-UHFFFAOYSA-N
- 24828596
MolClass #46251
CFHWAVVAKZUYKT-UHFFFAOYSA-N
- 858269
MolClass #46252
NPWSWQCSIQQZGY-SAPNQHFASA-N
- 24807975
MolClass #46253
XQYSXXHVPOUFJP-UHFFFAOYSA-N
- 24825496
MolClass #46254
FGYOTLRHCMOVPU-ZRDIBKRKSA-N
- 14720818
MolClass #46255
UPMBNNFXQFESIN-UHFFFAOYSA-N
- 4242823
MolClass #46256
- 14740693
MolClass #46257
RHQCCEHGFGFOFZ-UHFFFAOYSA-N
- 7972217
MolClass #46258
XQXBAUAPLJWFQS-UHFFFAOYSA-N
- 851683
MolClass #46259
JLWOZTUMLCZCDP-UHFFFAOYSA-N
- 17406883
MolClass #46260
YMIIOZSXFDNDMS-UHFFFAOYSA-N
- 22413995
MolClass #46261
- 17505686
MolClass #46262
MGUQKBPSRZJMHA-ZMOGYAJESA-N
- 851772
MolClass #46263
SYXCGDBAJXDIOY-UHFFFAOYSA-N
- 17402935
MolClass #46264
LBICDZLPOYIPOY-UHFFFAOYSA-N
- 850809
MolClass #46265
IAPSPNAQANIXMR-UHFFFAOYSA-N
- 848106
MolClass #46266
HJEBPRVKGJEECP-UHFFFAOYSA-N
- 4249690
MolClass #46267
HHJPLTDQNWQXGS-UHFFFAOYSA-N
- 24821673
MolClass #46268
UKKVANDFEBKGCK-LCYFTJDESA-N
- 7966418
MolClass #46269
WYPTXDSZVQEKEF-UHFFFAOYSA-N
- 24817385
MolClass #46270
XSUXIEYPCULTEO-UHFFFAOYSA-N
- 17407226
MolClass #46271
- 24804455
MolClass #46272
MAIUROUKGUOFLR-UHFFFAOYSA-N
- 24839220
MolClass #46273
CVLDMRYLTARUHO-UHFFFAOYSA-N
- 14738006
MolClass #46274
OXDJWTXFWKPLMP-UHFFFAOYSA-N
- 24795072
MolClass #46275
CQZWWPQYTPYYAE-UHFFFAOYSA-N
- 845273
MolClass #46276
FRKLHYPYUBUYJK-UHFFFAOYSA-N
- 17506177
MolClass #46277
- 24786745
MolClass #46278
COYLNHITVXBZPK-UHFFFAOYSA-N
- 4244073
MolClass #46279
- 17513610
MolClass #46280
WCCPWIIVOLECPJ-UHFFFAOYSA-N
- 24834010
MolClass #46281
YIOPFSQGBMIWIW-ISLYQWMRSA-N
- 24802694
MolClass #46282
AZAXRUNIGYYEKS-UHFFFAOYSA-N
- 14742103
MolClass #46283
ABFKDTFPJXQMDV-UHFFFAOYSA-N
- 24797665
MolClass #46284
- 843371
MolClass #46285
MZEXRCSVJIGQQE-UHFFFAOYSA-N
- 17512744
MolClass #46286
FNUFLICOJROSHP-GBXBDOIYSA-N
- 24793327
MolClass #46287
SRTJCOPFMBONLF-UHFFFAOYSA-N
- 7973889
MolClass #46288
NPGRAIIBMVPZHD-UHFFFAOYSA-N
- 14729919
MolClass #46289
QNYBFIZQNLPGEE-UHFFFAOYSA-N
- 4249601
MolClass #46290
CUYRWAZJMNJTTR-UHFFFAOYSA-N
- 842854
MolClass #46291
XCBYQPNJMTUSPH-UHFFFAOYSA-N
- 22405069
MolClass #46292
OKAJPZPOWWDYPO-NTUHNPAUSA-N
- 14736036
MolClass #46293
VITWOVCXQXKNAC-AOXGIJKRSA-N
- 24828732
MolClass #46294
AKSORMFMDHHKDA-UHFFFAOYSA-N
- 7971013
MolClass #46295
CQMSJPUAVGBAMK-OWBHPGMISA-N
- 24802624
MolClass #46296
FLICSFLKDCECGU-UTCJRWHESA-N
- 22409226
MolClass #46297
GLJDLAQFRVFTBM-UHFFFAOYSA-N
- 17512847
MolClass #46298
ZROLXFWUWWUQNO-UHFFFAOYSA-N
- 22405136
MolClass #46299
XTNZCJYQMATSAZ-UHFFFAOYSA-N
- 4249733
MolClass #46300
FKFACKNBGDFEOK-UHFFFAOYSA-N