Molecule directory
Explore structures, source datasets and saved model predictions for molecules registered in MolClass.
Search by molecule name, identifier or structure →- 3068804
MolClass #12001
GNYCTMYOHGBSBI-SUDYOERFSA-N
- 2113458
MolClass #12002
- 3090091
MolClass #12003
ZVLOPMNVFLSSAA-XEPQRQSNSA-N
- 2153
MolClass #12004
DLEDLHFNQDHEOJ-WNRHQEOASA-N
- 3199281
MolClass #12005
MBXKEYXHJAZKBP-DEKFOEGESA-N
- 3076299
MolClass #12006
NLUGUZJQJYVUHS-OHNBVLBNSA-N
- 3199379
MolClass #12007
- 3076304
MolClass #12008
- 1096696
MolClass #12009
FVYXIJYOAGAUQK-UHFFFAOYSA-N
- 907437
MolClass #12010
HXQRGYNEDCHJPJ-WCSIJFPASA-N
- 3076310
MolClass #12011
UQYAGFYEWGSYHY-LTLIZFCHSA-N
- 3199386
MolClass #12012
LMBUCBUQBOEBPU-CPQWXXETSA-N
- 3199387
MolClass #12013
ZDQSOHOQTUFQEM-AMASXYNMSA-N
- 832324
MolClass #12014
UDPIGEIYWVCFED-RBWCRZADSA-N
- 3076316
MolClass #12015
FALILNHGILFDLC-UHFFFAOYSA-N
- 2345
MolClass #12016
HDZZVAMISRMYHH-FBSDJGSXSA-N
- 2327
MolClass #12017
POKQZZZUBVLNLG-HSWKEQASSA-N
- 3076760
MolClass #12018
XQDCKJKKMFWXGB-UHFFFAOYSA-N
- 1320
MolClass #12019
FXLVCCDIUNLGKU-BRUCSKOJSA-N
- 1001972
MolClass #12020
TWWQHCKLTXDWBD-MVTGTTCWSA-N
- 3076766
MolClass #12021
XOKJULOVXVISRP-BWMVHVDHSA-N
- 3076821
MolClass #12022
AERBNCYCJBRYDG-KSZLIROESA-N
- 2334
MolClass #12023
KWSXUGYAGMSUTN-LGMDPLHJSA-N
- 3076270
MolClass #12024
JEKMKNDURXDJAD-JUKDXYPLSA-N
- 3199602
MolClass #12025
JPWPYTMXSXYUPG-QZPYEDBESA-N
- 3076167
MolClass #12026
DAIKHDNSXMZDCU-WMTWXYRJSA-N
- 874122
MolClass #12027
JWFLIMIGORGZMQ-UHFFFAOYSA-N
- 3076290
MolClass #12028
HKLDUJXJTQJSEJ-OLXNOMCWSA-N
- 3076448
MolClass #12029
- 3076498
MolClass #12030
WYZWZEOGROVVHK-JVLMNHKTSA-N
- 3199700
MolClass #12031
MCPFEAJYKIXPQF-YUHHNXHOSA-N
- 3199701
MolClass #12032
QAJWKFYVBWJRPG-ZKUZTEBESA-N
- 2329
MolClass #12033
WWZMXEIBZCEIFB-BNTGGEEQSA-N
- 3076615
MolClass #12034
OPQNCARIZFLNLF-KLGURBLHSA-N
- 3199793
MolClass #12035
GAZDXIGXYWVWQX-XVXFOSSISA-N
- 3199795
MolClass #12036
UKQNIEMKORIOQM-KRQHZRJMSA-N
- 3076873
MolClass #12037
ORXQGKIUCDPEAJ-YRNVUSSQSA-N
- 3199899
MolClass #12038
BMVYERDNLNLZPE-GRQCBIRASA-N
- 1817
MolClass #12039
ZDZOTLJHXYCWBA-PLPCXQGQSA-N
- 2141196
MolClass #12040
QUFQQVZOEGMBEO-XROHWGENSA-N
- 2141375
MolClass #12041
DCTHMSZFEXSQQN-DRVGFJBOSA-N
- 2141397
MolClass #12042
GPNPAQWJFMPKFD-HMFYUPBTSA-N
- 2141689
MolClass #12043
NQKWGBPXWVRIKD-AHEYRSCFSA-N
- 2141727
MolClass #12044
DCTHMSZFEXSQQN-UEWBMVEHSA-N
- 2141881
MolClass #12045
CHLYAPCTDAMDNR-LRWJMQQGSA-N
- 2141925
MolClass #12046
CHLYAPCTDAMDNR-HKFRCHOZSA-N
- 3187117
MolClass #12047
MVBVGBQAMVQISC-UHFFFAOYSA-N
- 3187120
MolClass #12048
LJDRGBBZOTVDGC-UHFFFAOYSA-N
- 3189665
MolClass #12049
TTXUTHXSBFSIOM-AVRJXOLHSA-N
- 3187737
MolClass #12050
YMVNXNPARPKJQW-JOCHJYFZSA-N
- 3071583
MolClass #12051
RPUBZXXWGGZWRP-ZOXCZHJPSA-N
- 3085328
MolClass #12052
YHLLABKHTFWHSZ-UHFFFAOYSA-N
- 3551925
MolClass #12053
IEVPTEVAHZRSPP-LDADJPATSA-N
- 3551946
MolClass #12054
RHVJINZCDGNUKS-CXUHLZMHSA-N
- 3551950
MolClass #12055
GQOWDRYCVQDOKL-CXUHLZMHSA-N
- 3551953
MolClass #12056
NYFGZXMXYMPJAE-CXUHLZMHSA-N
- 3551957
MolClass #12057
IJZILDJVOPMMJT-CGZFJWOTSA-N
- 3551980
MolClass #12058
YLCXKDOYGJTUOX-RQZCQDPDSA-N
- 3552033
MolClass #12059
UMWYHLIWMXZRQO-CXUHLZMHSA-N
- 3552037
MolClass #12060
NGEFYNPFTYPFDB-LZYBPNLTSA-N
- 3552041
MolClass #12061
BCGXWFSQSOPZSL-YIERNNEGSA-N
- 3552044
MolClass #12062
HDGNFCIARMUSOU-CRRKTRLDSA-N
- 3552062
MolClass #12063
FWCLTYYMXFHMFZ-REZTVBANSA-N
- 3552065
MolClass #12064
UGCRFPWHYFJEQK-HAVVHWLPSA-N
- 3552091
MolClass #12065
IZHWUQGNICKCJL-OVCLIPMQSA-N
- 3552142
MolClass #12066
WAFYGXXLTQAURQ-GIJQJNRQSA-N
- 3552175
MolClass #12067
DEOSKXWOSHZQFX-CXUHLZMHSA-N
- 3552205
MolClass #12068
ZZSJOLDICPVVAV-YBFXNURJSA-N
- 3552209
MolClass #12069
XUSLECFWDJAYTG-YBFXNURJSA-N
- 3552211
MolClass #12070
AZFAWNDHBLPYOI-OVCLIPMQSA-N
- 3552215
MolClass #12071
ICFIGMOXWCFOMA-OVCLIPMQSA-N
- 3552219
MolClass #12072
NJJNUZUZOJYQEK-YBFXNURJSA-N
- 3552223
MolClass #12073
- 3552228
MolClass #12074
OZCORVIRWFJDMG-CTIKDXGYSA-N
- 3552232
MolClass #12075
HHNUQTWHVVKYHD-NTUHNPAUSA-N
- 3552237
MolClass #12076
- 3552305
MolClass #12077
IVPDNRPVBINUSS-DJKKODMXSA-N
- 3552309
MolClass #12078
QCYYBXWTRITALG-VIZOYTHASA-N
- 3552317
MolClass #12079
IKMRAVBTJQOGAR-VCHYOVAHSA-N
- 3552502
MolClass #12080
AVYSXEPJZMLKRB-LPYMAVHISA-N
- 3552578
MolClass #12081
WHSPCQCHUNSIGE-XDHOZWIPSA-N
- 3552673
MolClass #12082
GRHKLRYTPWLWRT-GZTJUZNOSA-N
- 3552787
MolClass #12083
OFYVZWQBZQQEGY-NTUHNPAUSA-N
- 3553009
MolClass #12084
TWGVRODUQZPDPE-VCHYOVAHSA-N
- 3553084
MolClass #12085
VZOFDWNEBLLIAN-YDZHTSKRSA-N
- 3553145
MolClass #12086
YAFCKQNBYHPIFX-JJIBRWJFSA-N
- 3553366
MolClass #12087
BQNPQBKSNLHXPI-LZYBPNLTSA-N
- 3553748
MolClass #12088
BMZCAPLCHIENPY-YDZHTSKRSA-N
- 3553873
MolClass #12089
AAYBUIRGYJXTIE-YDZHTSKRSA-N
- 3554040
MolClass #12090
- 3554511
MolClass #12091
XDHNQDDQEHDUTM-KDKMRFPSSA-N
- 3556548
MolClass #12092
KJWWXHXJAYHBGD-ZEQRLZLVSA-N
- 3556554
MolClass #12093
HXGUKKFFAMFVLN-IOPIWRGFSA-N
- 3556564
MolClass #12094
VLEZNPUOWVYYJU-RFGUZVAMSA-N
- 3556643
MolClass #12095
ULEFYRLZEKNFJE-MONYTURTSA-N
- 3556672
MolClass #12096
DFVWLVWIOBUJHZ-GKWGUFPOSA-N
- 3556674
MolClass #12097
ANKGNVSFGMUTDP-CFTPNRCCSA-N
- 3556685
MolClass #12098
UKRUWHKVOHLICO-RXFWQSSRSA-N
- 3562114
MolClass #12099
KKTAUKYIHGLBHO-UHFFFAOYSA-N
- 3614389
MolClass #12100
XZVJNBMIUPKZHF-DHZHZOJOSA-N