Molecule directory
Explore structures, source datasets and saved model predictions for molecules registered in MolClass.
Search by molecule name, identifier or structure →- 3232987
MolClass #10201
LNFOXFZVGRTHAZ-UHFFFAOYSA-N
- 3232918
MolClass #10202
ASNNYNPOUQSBOP-UHFFFAOYSA-N
- 3232888
MolClass #10203
OTNCAAWQLXFHPO-UHFFFAOYSA-N
- 3232868
MolClass #10204
SWQPPSIXYUDEOI-UHFFFAOYSA-N
- 3232824
MolClass #10205
- 3232820
MolClass #10206
WHKUIXXXHLWMPL-UHFFFAOYSA-N
- 3232795
MolClass #10207
WUKDIOLZVMZGRP-UHFFFAOYSA-N
- 3232775
MolClass #10208
GININQDBFYGKGX-UHFFFAOYSA-N
- 3237432
MolClass #10209
MIOPEGLZQSMOPA-UHFFFAOYSA-N
- 3232734
MolClass #10210
GMBJJMHTWIGFPH-HXUWFJFHSA-N
- 3232717
MolClass #10211
NKTLLAFDKOAHDB-UHFFFAOYSA-N
- 3232624
MolClass #10212
JXCOICYQIJLGIS-UHFFFAOYSA-N
- 3232606
MolClass #10213
NKMNZYCGWXXHRS-UHFFFAOYSA-N
- 3232600
MolClass #10214
- 3162309
MolClass #10215
- 3155707
MolClass #10216
NXJNINUNSFIGJN-UHFFFAOYSA-N
- 3154407
MolClass #10217
UOOMRAKLNOZSDI-UHFFFAOYSA-N
- 3146434
MolClass #10218
JGBTUCRGHJMNFX-BUHFOSPRSA-N
- 3145788
MolClass #10219
MMYCMZWBOZKRRV-UHFFFAOYSA-N
- 3144344
MolClass #10220
UZPBLLFTUZJQMD-UHFFFAOYSA-N
- 3129893
MolClass #10221
MXUQGHVBDMUJLL-UHFFFAOYSA-N
- 3129754
MolClass #10222
BWNPKMKDYBUTPV-UHFFFAOYSA-N
- 3080554
MolClass #10223
HQPMJFFEXJELOQ-UHFFFAOYSA-N
- 3013166
MolClass #10224
- 3000213
MolClass #10225
MHZGNYZMAMJBFE-UHFFFAOYSA-N
- 3000142
MolClass #10226
XLOJOFCNWNGSGN-UHFFFAOYSA-N
- 3000114
MolClass #10227
HSRHOKLBADNCMO-UHFFFAOYSA-N
- 3000003
MolClass #10228
ODXZMIYAIOAUCQ-UHFFFAOYSA-N
- 2999855
MolClass #10229
UGNOLUWFVBYSOO-UHFFFAOYSA-N
- 2999765
MolClass #10230
OKPMCWIIYRPBPE-UHFFFAOYSA-N
- 2999733
MolClass #10231
BEMGGMHRNBEBHI-UHFFFAOYSA-N
- 2999645
MolClass #10232
HHKODPGQVZDKJM-UHFFFAOYSA-N
- 2999597
MolClass #10233
SDILSNVRGSVYPJ-UHFFFAOYSA-N
- 2999554
MolClass #10234
WMOPYCFZTMOOOS-UHFFFAOYSA-N
- 2999507
MolClass #10235
LCWAXFDFQCIKKI-UHFFFAOYSA-N
- 2999375
MolClass #10236
IUJMZOWHMWOMAX-UHFFFAOYSA-N
- 2999347
MolClass #10237
WCQJJOIGIVFMKQ-UHFFFAOYSA-N
- 2999236
MolClass #10238
WJZZDFIJBSDWAA-NFFXIYMHSA-N
- 2999227
MolClass #10239
FYFAIFOZTHGUNF-UHFFFAOYSA-N
- 2999130
MolClass #10240
AYQRWVLKIAMNON-UHFFFAOYSA-N
- 2999043
MolClass #10241
TWVUZMQFOHDXGV-UHFFFAOYSA-N
- 2998964
MolClass #10242
YARWAOOHYQHUQY-UHFFFAOYSA-N
- 2998954
MolClass #10243
XJQCHMWUHJXDOM-HNENSFHCSA-N
- 2998894
MolClass #10244
JMORYDPFQCYQGK-UHFFFAOYSA-N
- 2998675
MolClass #10245
XTOAWMVAZOOIGP-BZZOAKBMSA-N
- 2998536
MolClass #10246
WNWZXQSQLRVQOK-UHFFFAOYSA-N
- 2998496
MolClass #10247
MDNDDGAMPQNOTB-UHFFFAOYSA-N
- 2998454
MolClass #10248
ZJNOYQKBMKMKHR-UHFFFAOYSA-N
- 2998399
MolClass #10249
CKZHUGNNWROEQM-UHFFFAOYSA-N
- 2998398
MolClass #10250
BAJDJSODTWZFSS-UHFFFAOYSA-N
- 3245369
MolClass #10251
IXVDEHUXRBUKNN-UHFFFAOYSA-N
- 2998355
MolClass #10252
USTQBQSRAQTWIR-UHFFFAOYSA-N
- 2998287
MolClass #10253
QPHIYTASRVTYFN-UHFFFAOYSA-N
- 2998254
MolClass #10254
ANPOYQGOJKSRRN-UHFFFAOYSA-N
- 2998196
MolClass #10255
BUDWWCFXAAVIMG-UHFFFAOYSA-N
- 2998095
MolClass #10256
WXIIMGMKPKXCJW-UHFFFAOYSA-N
- 2997948
MolClass #10257
SSWVPYMSHHEYAB-UHFFFAOYSA-N
- 2997882
MolClass #10258
VZELEVCSLRBHEE-UHFFFAOYSA-N
- 2997868
MolClass #10259
JDIMXSHKKMKXJN-UHFFFAOYSA-N
- 2997692
MolClass #10260
PPFNPWUFCNYZBI-UHFFFAOYSA-N
- 2997586
MolClass #10261
MYRRYYMORBWNDM-UHFFFAOYSA-N
- 2997521
MolClass #10262
LZOCRTGDFVXVLX-UHFFFAOYSA-N
- 2991012
MolClass #10263
YPQBSWGZNYBRED-UHFFFAOYSA-N
- 3236267
MolClass #10264
HEWFAQZCBIKHBE-UHFFFAOYSA-N
- 2987989
MolClass #10265
LIGCTZRUBJVJHF-UHFFFAOYSA-N
- 2987428
MolClass #10266
CRZNLHGYSRBOQL-UHFFFAOYSA-N
- 2985365
MolClass #10267
BIXFAKJKVRUCNU-UHFFFAOYSA-N
- 2983680
MolClass #10268
KXIOCPFOQDRJBQ-UHFFFAOYSA-N
- 2989573
MolClass #10269
PFXVPQCNGGTFIM-UHFFFAOYSA-N
- 2981336
MolClass #10270
NVIDTYXZJHTAHL-UHFFFAOYSA-N
- 3234447
MolClass #10271
GEPNMSLRGWQWCE-UHFFFAOYSA-N
- 3239428
MolClass #10272
QWTBMWLGTUEWKB-UHFFFAOYSA-N
- 2976031
MolClass #10273
LLQYMTZXJVPODZ-UHFFFAOYSA-N
- 2974150
MolClass #10274
ZUWQXYDMMUZDNB-UHFFFAOYSA-N
- 2973196
MolClass #10275
IYNXJRSJKJVPQY-UHFFFAOYSA-N
- 2972189
MolClass #10276
TWUHJIAGJSKONL-UHFFFAOYSA-N
- 2970793
MolClass #10277
XMJAYOZOYVQYFU-UHFFFAOYSA-N
- 2964769
MolClass #10278
YCIBNYVYONMKAB-UHFFFAOYSA-N
- 2964766
MolClass #10279
BYNBLLASEBQKPK-UHFFFAOYSA-N
- 2964585
MolClass #10280
MIWUSICSAIXABD-UHFFFAOYSA-N
- 2964469
MolClass #10281
ZCUIAOVCAOGBLQ-UHFFFAOYSA-N
- 2963508
MolClass #10282
YYDPYCVTMNIQCM-UHFFFAOYSA-N
- 2963490
MolClass #10283
AMVIYBUBHKBEIY-UHFFFAOYSA-N
- 2962539
MolClass #10284
JUQKGIKRKGDJLN-UHFFFAOYSA-N
- 3234136
MolClass #10285
UAAMMPIEVGTBAO-UHFFFAOYSA-N
- 2960269
MolClass #10286
- 2958516
MolClass #10287
DRISEDISKPZJOH-UHFFFAOYSA-N
- 2958466
MolClass #10288
BGBVXEDRBCZGAM-UHFFFAOYSA-N
- 2958352
MolClass #10289
ONEHYZISXLZYNP-UHFFFAOYSA-N
- 2957275
MolClass #10290
- 2955479
MolClass #10291
TWXZLYPACKUXHY-UHFFFAOYSA-N
- 2954742
MolClass #10292
OJZRHNKMJKSJPS-UHFFFAOYSA-N
- 2954106
MolClass #10293
GEAMHMBWFNQRTB-UHFFFAOYSA-N
- 2953653
MolClass #10294
YJOYTQQCKRNIPB-UHFFFAOYSA-N
- 2952929
MolClass #10295
XLRGQNBOMWDNQD-UHFFFAOYSA-N
- 2950692
MolClass #10296
TVLFXJRSLIUIJZ-UHFFFAOYSA-N
- 2950422
MolClass #10297
MBYJFTPFDQFWPW-UHFFFAOYSA-N
- 2950328
MolClass #10298
PFQRLBDBBOSSGI-UHFFFAOYSA-N
- 2949719
MolClass #10299
VAUQZYVHGDOEDQ-UHFFFAOYSA-N
- 2946788
MolClass #10300