Molecule directory
Explore structures, source datasets and saved model predictions for molecules registered in MolClass.
Search by molecule name, identifier or structure →- 4242089
MolClass #52201
ZYGYCMUYEJACGI-UHFFFAOYSA-N
- 4241990
MolClass #52202
IJPPTSNWQLJFSU-UHFFFAOYSA-N
- 4241976
MolClass #52203
JXSGNDWADNFDPJ-UHFFFAOYSA-N
- 4241788
MolClass #52204
CWEQNOCKADKALC-UHFFFAOYSA-N
- 4241755
MolClass #52205
WVLKWEDRVURCNW-UHFFFAOYSA-N
- 4241736
MolClass #52206
AAFWGXZKDLGSEQ-UHFFFAOYSA-N
- 4241705
MolClass #52207
GDWKPMUEBXJFQK-UHFFFAOYSA-N
- 4241667
MolClass #52208
YRJSXTZPEOLILU-UHFFFAOYSA-N
- 4241108
MolClass #52209
OZJZAHYJFKHRHA-UHFFFAOYSA-N
- 4241378
MolClass #52210
CPHJFOQNOWEJIZ-UHFFFAOYSA-N
- 4241358
MolClass #52211
PEMMDQSTUVDFAX-UHFFFAOYSA-N
- 4241300
MolClass #52212
LFXCGFKWLAWDDN-UHFFFAOYSA-N
- 4241295
MolClass #52213
BCHAKAQIAKWFAO-UHFFFAOYSA-N
- 4241195
MolClass #52214
OMSOQKOICUVLSK-UHFFFAOYSA-N
- 4241140
MolClass #52215
ZHMSDLMUONAZKI-UHFFFAOYSA-N
- 4241084
MolClass #52216
LWNRFDYFXURUJL-UHFFFAOYSA-N
- 4240997
MolClass #52217
WVXGWMKPDDWOAF-UHFFFAOYSA-N
- 4240788
MolClass #52218
- 4240758
MolClass #52219
NPIJXUGEZHABCE-UHFFFAOYSA-N
- 4240720
MolClass #52220
YJTBZAIQVCAIKI-UHFFFAOYSA-N
- 4240702
MolClass #52221
ORMXZERYCGCFMJ-UHFFFAOYSA-N
- 4240557
MolClass #52222
UXNSRPYCGXGIHH-UHFFFAOYSA-N
- 4240480
MolClass #52223
SBUZRPHSJBKVMF-UHFFFAOYSA-N
- 3717981
MolClass #52224
JCKHCANZNYXGFE-UHFFFAOYSA-N
- 3717312
MolClass #52225
LWRVPLVNFMWCJA-UHFFFAOYSA-N
- 3716599
MolClass #52226
IZTKXMAXDZYMPH-UHFFFAOYSA-N
- 3716952
MolClass #52227
BRJHWFYMRHVVEW-UHFFFAOYSA-N
- 3717354
MolClass #52228
WFHSOVJJZPRWFH-UHFFFAOYSA-N
- 3717175
MolClass #52229
VYHPGJDPDZATLD-UHFFFAOYSA-N
- 3717094
MolClass #52230
PJBUNGKYGVSJMP-UHFFFAOYSA-N
- 3717634
MolClass #52231
CJDWLSPYPPAPQZ-UHFFFAOYSA-N
- 3716898
MolClass #52232
AWTSBIQBPVMWIT-UHFFFAOYSA-N
- 3716630
MolClass #52233
JHAMGSJDLVIXQK-UHFFFAOYSA-N
- 3717015
MolClass #52234
BSCJGOVRDFHXFF-UHFFFAOYSA-N
- 3716169
MolClass #52235
- 3716576
MolClass #52236
IMYGPCCRJQSNBJ-UHFFFAOYSA-N
- 3716365
MolClass #52237
JFOVNJQCUHRYOI-UHFFFAOYSA-N
- 3716152
MolClass #52238
HOSFWXIHCJNZNM-UHFFFAOYSA-N
- 3716494
MolClass #52239
SJCMXDBERDEFQU-UHFFFAOYSA-N
- 3716201
MolClass #52240
DEQWWOJJTAHLQN-UHFFFAOYSA-N
- 3716151
MolClass #52241
ZUTAISMUPDIEPE-UHFFFAOYSA-N
- 3716415
MolClass #52242
JNQCFZQNFFVHDL-UHFFFAOYSA-N
- 3716223
MolClass #52243
- 3716367
MolClass #52244
DGTWSXWDJPTQCX-UHFFFAOYSA-N
- 3716074
MolClass #52245
ZVKQQLQTBIEXSC-UHFFFAOYSA-N
- 3716379
MolClass #52246
DVTNYDUYSOLOMJ-UHFFFAOYSA-N
- 3715743
MolClass #52247
QSYJBBIVXVGYMR-UHFFFAOYSA-N
- 3715455
MolClass #52248
HUTOKBCXOXAXPD-UHFFFAOYSA-N
- 3715066
MolClass #52249
BNZSMYYIQWTHIH-UHFFFAOYSA-N
- 3714907
MolClass #52250
RAPYCYNSEAIRJF-DJKKODMXSA-N
- 3714564
MolClass #52251
WSVKPFGFYGKJMK-UHFFFAOYSA-N
- 3714540
MolClass #52252
IXDJYQQQIXMOAX-UHFFFAOYSA-N
- 3714242
MolClass #52253
DVVUMRAOPIVJBY-UHFFFAOYSA-N
- 3713937
MolClass #52254
DILRWRGHNOFPNG-UHFFFAOYSA-N
- 3713847
MolClass #52255
IJIJOMIPACAFLX-UHFFFAOYSA-N
- 3715504
MolClass #52256
ORGNRSIXAIRUBX-UHFFFAOYSA-N
- 3715148
MolClass #52257
RMZOHOSSJSLVNL-UHFFFAOYSA-N
- 3715228
MolClass #52258
RXGOVROXXAMPGX-UHFFFAOYSA-N
- 3713943
MolClass #52259
DZAQEXJIYVGGBH-UHFFFAOYSA-N
- 3715250
MolClass #52260
AONIHJLTBUXIQP-UHFFFAOYSA-N
- 3715132
MolClass #52261
PBCPHFZLJSKNMM-UHFFFAOYSA-N
- 3714591
MolClass #52262
HKBFPIAHBQIBJT-UHFFFAOYSA-N
- 3715150
MolClass #52263
OLMOQRUABDEHPS-UHFFFAOYSA-N
- 3714376
MolClass #52264
UZWPULKPZLNEGI-UHFFFAOYSA-N
- 3714484
MolClass #52265
OCNOLNMRHMUDHF-UHFFFAOYSA-N
- 3713696
MolClass #52266
MJXGEPXIEGAWMF-UHFFFAOYSA-N
- 3713621
MolClass #52267
VSAJCXCOANWJHO-UHFFFAOYSA-N
- 3712667
MolClass #52268
VTARJFYRXDMCGG-UHFFFAOYSA-N
- 3713738
MolClass #52269
KLHAFRNGIGBJIV-UHFFFAOYSA-N
- 3712666
MolClass #52270
AXDIMKHPEMQOND-UHFFFAOYSA-N
- 3713046
MolClass #52271
RQWIKAIWLUIHOM-UHFFFAOYSA-N
- 3713503
MolClass #52272
GHUOKLVMULNZKL-UHFFFAOYSA-N
- 3712291
MolClass #52273
IMCWXXOAXKYHGZ-UHFFFAOYSA-N
- 3712373
MolClass #52274
PCHWQEUBCTXSCT-UHFFFAOYSA-N
- 3712240
MolClass #52275
ZRGSCGXHLIYIJC-UHFFFAOYSA-N
- 3712397
MolClass #52276
NPLYGIRPYYNAQH-UHFFFAOYSA-N
- 3711945
MolClass #52277
SUJVYXLEROJSQA-UHFFFAOYSA-N
- 3711983
MolClass #52278
PLLUDWKUWZMKSY-UHFFFAOYSA-N
- 3711634
MolClass #52279
YJJCBEDWBFANCM-CTDHQONLSA-N
- 3711170
MolClass #52280
LHAKKUYATKQKCW-UHFFFAOYSA-N
- 3711453
MolClass #52281
- 3711644
MolClass #52282
OHFMLRVCECJTIJ-UHFFFAOYSA-N
- 3711443
MolClass #52283
FMBYJURAMZMJQI-UHFFFAOYSA-N
- 3711631
MolClass #52284
KBSSLURKVBNDSL-UHFFFAOYSA-N
- 866121
MolClass #52285
- 866093
MolClass #52286
IUWCBSWRZIANNQ-UHFFFAOYSA-N
- 866021
MolClass #52287
YGLDLSMARTWODG-UHFFFAOYSA-N
- 865945
MolClass #52288
NRYUZDWKDIXETJ-UHFFFAOYSA-N
- 865627
MolClass #52289
ORPBHPCDRSTPAS-UHFFFAOYSA-N
- 865607
MolClass #52290
JLGKOPXKDAPDID-UHFFFAOYSA-N
- 864773
MolClass #52291
FRBYEGJZPFGBKQ-UHFFFAOYSA-N
- 863765
MolClass #52292
OYOPDPNOZYCMMQ-UHFFFAOYSA-N
- 864526
MolClass #52293
XMZIKJSSUQHDSS-UHFFFAOYSA-N
- 864057
MolClass #52294
APRGBLOXXLPHPL-UHFFFAOYSA-N
- 865366
MolClass #52295
JVTNXTPMAYXOIA-UHFFFAOYSA-N
- 865232
MolClass #52296
RQZZDKRLSZFNAC-UHFFFAOYSA-N
- 865217
MolClass #52297
ZCTBPADECTYBBN-UHFFFAOYSA-N
- 865021
MolClass #52298
CYKISVYTUCOJRU-UHFFFAOYSA-N
- 865012
MolClass #52299
CKQYQAZAMQUMRT-UHFFFAOYSA-N
- 864717
MolClass #52300
BJVVHVXNLXVRFS-UHFFFAOYSA-N