Molecule directory
Explore structures, source datasets and saved model predictions for molecules registered in MolClass.
Search by molecule name, identifier or structure →- K786-6067
MolClass #25001
SYSPGYKZUMUXHH-UHFFFAOYSA-N
- K786-7070
MolClass #25002
INESHQRMQNXCLI-UHFFFAOYSA-N
- K786-8616
MolClass #25003
XEVOPFSBTAEWDL-UHFFFAOYSA-N
- K786-9133
MolClass #25004
BRJLKLUEBUPHID-UHFFFAOYSA-N
- K786-9281
MolClass #25005
SOYAKNVHIRRFKD-UHFFFAOYSA-N
- K786-9748
MolClass #25006
UKYBUVHPGFARTM-UHFFFAOYSA-N
- K786-9819
MolClass #25007
BUPLYGVYBYQLMQ-UHFFFAOYSA-N
- K788-2054
MolClass #25008
GPUHIRSALCEOGX-UHFFFAOYSA-N
- K788-4742
MolClass #25009
SEFIWUXDMAMJCB-UHFFFAOYSA-N
- K788-4771
MolClass #25010
FHOYXOODITYNOS-UHFFFAOYSA-N
- K788-5171
MolClass #25011
YARXSBVTGRRCLP-UHFFFAOYSA-N
- K815-0060
MolClass #25012
UDFPKNSWSYBIHO-UHFFFAOYSA-N
- K894-0158
MolClass #25013
VRUIREXMUOVUQF-UHFFFAOYSA-N
- K906-0827
MolClass #25014
PCAMDPIZYVLVEN-UHFFFAOYSA-N
- K913-0321
MolClass #25015
ZHFRKSIPPVIXGP-UHFFFAOYSA-N
- K913-0335
MolClass #25016
ICSZLXBAMPLANF-UHFFFAOYSA-N
- K917-0535
MolClass #25017
SRVSALFTTOUQHX-UHFFFAOYSA-N
- K940-0510
MolClass #25018
NKZFZKLFBUTECZ-UHFFFAOYSA-N
- K940-1409
MolClass #25019
ZHJICPWZVBEMHK-UHFFFAOYSA-N
- K979-0460
MolClass #25020
UAAPOZOLYKPYSD-UHFFFAOYSA-N
- R152-0738
MolClass #25021
XKPFQOBZDFZXHZ-UHFFFAOYSA-N
- 3254-3297
MolClass #25022
- 3253-4022
MolClass #25023
- 8004-4258
MolClass #25024
IGVJKIGDCBTNFL-AFUMVMLFSA-N
- 2357-3049
MolClass #25025
- 8002-2154
MolClass #25026
IQWHSYJCRREXCG-YDZHTSKRSA-N
- 2681-3685
MolClass #25027
ZLNHBETZMJXNRN-ATVHPVEESA-N
- 4489-8151
MolClass #25028
KIFBFMQCRFFKLE-UHFFFAOYSA-N
- 3253-2326
MolClass #25029
- 8005-5186
MolClass #25030
WJFNIZNBXUMGPL-YDZHTSKRSA-N
- 3254-3286
MolClass #25031
- 8004-1260
MolClass #25032
LHOYRBRCQQNVEY-WRHQLWEMSA-N
- 2357-3050
MolClass #25033
- 4896-4994
MolClass #25034
PQUAXBXFGYTWLZ-PDGQHHTCSA-N
- 2124-0315
MolClass #25035
YTQRHWNROONRKR-BTXLNPSKSA-N
- 0906-2979
MolClass #25036
HYSGCYCMVZPHCV-NTUHNPAUSA-N
- K091-1157
MolClass #25037
WVJPKQXUTMQRTN-MDWZMJQESA-N
- 8007-4133
MolClass #25038
FBJMYPSLWJWMSA-KQQBXRMLSA-N
- 3254-3800
MolClass #25039
- 1910-1439
MolClass #25040
OIQHYLQORWQHHN-REZTVBANSA-N
- 3254-3219
MolClass #25041
LAWJCRBAEJWNMT-VGOFMYFVSA-N
- 2192-1322
MolClass #25042
DINWNLJUKNROJF-AUWJEWJLSA-N
- 8001-4897
MolClass #25043
YKVDXPXIRRYELS-UFFVCSGVSA-N
- 2262-4150
MolClass #25044
HPQOXEXNQXROAL-FRKPEAEDSA-N
- 8008-6105
MolClass #25045
SHXVGSXNZHKFQP-LSHDLFTRSA-N
- 3254-3201
MolClass #25046
UETMQMSWPHABIQ-VGOFMYFVSA-N
- 2113-0122
MolClass #25047
YWRZYHPZHHAORW-ZSOIEALJSA-N
- 3254-3578
MolClass #25048
- 3253-2866
MolClass #25049
- 8005-8816
MolClass #25050
MAFXBSVDQNIJJO-UFWORHAWSA-N
- 124973751
MolClass #25051
GAOZTHIDHYLHMS-QPJULDDXSA-M
- 124976359
MolClass #25052
NXJOCELNFPGKIV-ARHXXGKOSA-N
- 124976352
MolClass #25053
CTPOHARTNNSRSR-PCEABUQKSA-N
- 124973750
MolClass #25054
CFIUNEDKHWVQQS-SCLBCKFNSA-N
- 124968542
MolClass #25055
FZWBNHMXJMCXLU-BLAUPYHCSA-N
- 124971195
MolClass #25056
KRKNYBCHXYNGOX-UHFFFAOYSA-L
- 124971557
MolClass #25057
WZHCOOQXZCIUNC-UHFFFAOYSA-N
- 124976353
MolClass #25058
FRPGWHUNVVKIGD-UHFFFAOYSA-N
- 124971563
MolClass #25059
RTRQQBHATOEIAF-UUOKFMHZSA-N
- 124968540
MolClass #25060
KXKPYJOVDUMHGS-UHFFFAOYSA-N
- 124963590
MolClass #25061
CYOHGALHFOKKQC-UHFFFAOYSA-N
- 124965875
MolClass #25062
QGFORSXNKQLDNO-UHFFFAOYSA-N
- 124963227
MolClass #25063
WLUKGCDWLVMVSY-HUTDCKCPSA-N
- 124976357
MolClass #25064
KUEUWHJGRZKESU-UHFFFAOYSA-N
- 124965877
MolClass #25065
SFKQVVDKFKYTNA-UHFFFAOYSA-N
- 124960598
MolClass #25066
UIDWQGRXEVDFCA-XCVCLJGOSA-N
- 124965876
MolClass #25067
KIUKXJAPPMFGSW-DNGZLQJQSA-N
- 124957974
MolClass #25068
RDHQFKQIGNGIED-MRVPVSSYSA-N
- 124957620
MolClass #25069
WMUIIGVAWPWQAW-UHFFFAOYSA-N
- 124968882
MolClass #25070
FWKQNCXZGNBPFD-UHFFFAOYSA-N
- 124968541
MolClass #25071
RVUJJZCNKLABMP-UHFFFAOYSA-N
- 124971194
MolClass #25072
NIVFTEMPSCMWDE-UHFFFAOYSA-N
- 123094984
MolClass #25073
FUZKTZZNEXJRHQ-UFZDHURFSA-N
- 123094743
MolClass #25074
UGQMRVRMYYASKQ-KQYNXXCUSA-N
- 124976354
MolClass #25075
GCKFUYQCUCGESZ-UHFFFAOYSA-N
- 124968544
MolClass #25076
WRCITXQNXAIKLR-UHFFFAOYSA-N
- 124976539
MolClass #25077
RBAWEGYJSDPEHX-UHFFFAOYSA-O
- 124973749
MolClass #25078
CHBRHODLKOZEPZ-UHFFFAOYSA-N
- 124968897
MolClass #25079
RFRXIWQYSOIBDI-UHFFFAOYSA-N
- 123089867
MolClass #25080
- 123087815
MolClass #25081
AOJJSUZBOXZQNB-SHGQPOSGSA-N
- 124960991
MolClass #25082
YEKQSSHBERGOJK-UHFFFAOYSA-N
- 123085531
MolClass #25083
BDBMLMBYCXNVMC-UHFFFAOYSA-N
- 124973752
MolClass #25084
BENFXAYNYRLAIU-UHFFFAOYSA-N
- 123083205
MolClass #25085
HQRSUIDICNOLPX-UHFFFAOYSA-M
- 123094732
MolClass #25086
XLMALTXPSGQGBX-XMSQKQJNSA-N
- 124958351
MolClass #25087
DZLOHEOHWICNIL-UHFFFAOYSA-N
- 104247041
MolClass #25088
VIABIDFODSKCDL-KQSSXJRRSA-N
- 104243012
MolClass #25089
CDAISMWEOUEBRE-GPIVLXJGSA-N
- 104243011
MolClass #25090
WQZGKKKJIJFFOK-GASJEMHNSA-N
- 124965878
MolClass #25091
ZEAJXCPGHPJVNP-UHFFFAOYSA-N
- 104240363
MolClass #25092
YHDPWEWZPGTMMU-XXZPYRQZSA-N
- 124963228
MolClass #25093
WEYVCQFUGFRXOM-UHFFFAOYSA-N
- 104234372
MolClass #25094
AZFLJNIPTRTECV-FUMNGEBKSA-N
- 124974125
MolClass #25095
CMCCHHWTTBEZNM-UHFFFAOYSA-N
- 104234347
MolClass #25096
CEAZRRDELHUEMR-CAMVTXANSA-N
- 104234344
MolClass #25097
MYWUZJCMWCOHBA-VIFPVBQESA-N
- 124976355
MolClass #25098
FTCYIGBVOHNHCD-UHFFFAOYSA-N
- 104234256
MolClass #25099
CIDUJQMULVCIBT-MQDUPKMGSA-N
- 123083206
MolClass #25100
TVYLLZQTGLZFBW-UHFFFAOYSA-N