Molecule directory
Explore structures, source datasets and saved model predictions for molecules registered in MolClass.
Search by molecule name, identifier or structure →- 1951045
MolClass #18001
MQGBSWAVCIXXJY-AQTBWJFISA-N
- 1565470
MolClass #18002
DJSPGPZDNXCAFB-UHFFFAOYSA-N
- 1217989
MolClass #18003
- 3120812
MolClass #18004
ZXRLQODKPTXZNW-UHFFFAOYSA-N
- 3122471
MolClass #18005
YOQPDXMPNGKUIA-HUKVCQRGSA-N
- 1674114
MolClass #18006
AOAYKMHALLRULW-UHFFFAOYSA-N
- 1948061
MolClass #18007
BWYLTOJLBXOAJV-CAOOACKPSA-N
- 1533720
MolClass #18008
OEOTYPTVKQVKCV-UHFFFAOYSA-N
- 1932788
MolClass #18009
NOKFZWZALYFMLM-MDWZMJQESA-N
- 3024457
MolClass #18010
YNNMFPKTGNGOMS-UHFFFAOYSA-N
- 1976225
MolClass #18011
BGBNPGUKZZGPMX-UHFFFAOYSA-N
- 2068832
MolClass #18012
IVOHVBKVOPPQDX-UHFFFAOYSA-N
- 3120170
MolClass #18013
UEORRJHSGMOQOJ-UHFFFAOYSA-N
- 1946828
MolClass #18014
QBCSKDDXCWSUIG-OQLLNIDSSA-N
- 1776940
MolClass #18015
NVHAIHMHVSEXEQ-UHFFFAOYSA-N
- 1236131
MolClass #18016
IPZCRVUYKCHVKH-UHFFFAOYSA-N
- 2067780
MolClass #18017
FUAYEDDOAXHBOY-UHFFFAOYSA-N
- 1741267
MolClass #18018
YUSYZEUGWPQBCY-UHFFFAOYSA-N
- 421
MolClass #18019
YPHMISFOHDHNIV-LVMLBAMGSA-N
- 1514114
MolClass #18020
UJCQUMSZPQQONX-UHFFFAOYSA-N
- 1917525
MolClass #18021
CRHQYOSNYSIABT-RYKXSPESSA-N
- 3026878
MolClass #18022
CJNKBAKWQGYGIS-VQHVLOKHSA-N
- 1526229
MolClass #18023
OBODXNFPUOPWFD-UHFFFAOYSA-N
- 3034975
MolClass #18024
IRNHZUSJLSALNF-UHFFFAOYSA-N
- 907274
MolClass #18025
GOTMKOSCLKVOGG-OAHLLOKOSA-N
- 2066253
MolClass #18026
PFBKXIIHZHVUDJ-UHFFFAOYSA-N
- 1953726
MolClass #18027
OFKHODJHGGYCSG-UHFFFAOYSA-N
- 3123332
MolClass #18028
FSFDWQKGHUFECC-UHFFFAOYSA-N
- 1971843
MolClass #18029
VYXFOPUVZOZUMW-LHLOQNFPSA-N
- 3041005
MolClass #18030
CTGHQYZOYRGRHK-UHFFFAOYSA-N
- 1521979
MolClass #18031
BFQANTGWZCVHEO-UHFFFAOYSA-N
- 3121450
MolClass #18032
JHFHUWGRQADCRB-UHFFFAOYSA-N
- 3032330
MolClass #18033
YJBJHCHLDSUXCD-ACCUITESSA-N
- 1969314
MolClass #18034
ZUSOTXJNBKGKQZ-UHFFFAOYSA-N
- 1922506
MolClass #18035
PSGGKKOVZNCJLX-AWQFTUOYSA-N
- 1634062
MolClass #18036
QYZNJZOCRLRQDD-UHFFFAOYSA-N
- 1349561
MolClass #18037
XWVVLNASOXHMDH-UHFFFAOYSA-N
- 3026387
MolClass #18038
WAFZUFYLKGFMDT-LIMNOBDPSA-N
- 1156017
MolClass #18039
KNZBJLSNLKDGFN-UHFFFAOYSA-N
- 1946438
MolClass #18040
QEJLVHXLTGBOGR-ZRDIBKRKSA-N
- 3120950
MolClass #18041
CPVBFAPCYYMJNH-UHFFFAOYSA-N
- 1974247
MolClass #18042
JDBPNCSZIHLCFS-UHFFFAOYSA-N
- 1946085
MolClass #18043
- 1989205
MolClass #18044
NTIROGMLIRRKQH-UHFFFAOYSA-N
- 1364492
MolClass #18045
POTYJFCJQFUQMQ-UHFFFAOYSA-N
- 3025740
MolClass #18046
ASGZOHIKTAMBGT-MDZDMXLPSA-N
- 3119762
MolClass #18047
OREZDCBPAATILW-UHFFFAOYSA-N
- 1344235
MolClass #18048
RITWSFBPSKGAGF-UHFFFAOYSA-N
- 1924989
MolClass #18049
HDDBMPAGTLXSAW-UHFFFAOYSA-N
- 3122785
MolClass #18050
KBSCTGNEANFMTI-UHFFFAOYSA-N
- 1629562
MolClass #18051
- 1557708
MolClass #18052
XVACPGFHKFDSDD-UHFFFAOYSA-N
- 1494647
MolClass #18053
GCKPUOAMETYQMT-UHFFFAOYSA-N
- 1327154
MolClass #18054
- 1913261
MolClass #18055
UIJPWAAHRCPQHN-VLGSPTGOSA-N
- 1970164
MolClass #18056
CZAKPSNHDJRYTR-UHFFFAOYSA-N
- 1474513
MolClass #18057
WIVYSHHKZZGGHZ-UHFFFAOYSA-N
- 1579747
MolClass #18058
UFMJUWOLIFFYKD-UHFFFAOYSA-N
- 1947390
MolClass #18059
FZWUCEJPJYFOOI-MBEWDDOBSA-N
- 3022649
MolClass #18060
IDJQEYJDKDAWDT-UHFFFAOYSA-N
- 1916363
MolClass #18061
XGZQXJLWXOBROY-UHFFFAOYSA-N
- 1967885
MolClass #18062
PUXNYNBMISNTGK-UHFFFAOYSA-N
- 1164370
MolClass #18063
CKYIANUSVQDTEG-UHFFFAOYSA-N
- 1521690
MolClass #18064
JNPLXKYSOXVHAC-UHFFFAOYSA-N
- 1948287
MolClass #18065
JKQXVWLOZXGEDM-UHFFFAOYSA-N
- 1938038
MolClass #18066
DUOMIXYZNGEHMO-UHFFFAOYSA-N
- 2074749
MolClass #18067
KLUQOAISZAWDNK-UHFFFAOYSA-N
- 1936753
MolClass #18068
QVMGXDUTRPQTOO-UHFFFAOYSA-N
- 1937083
MolClass #18069
FTSMIVINWQJNND-FLIBITNWSA-N
- 1921904
MolClass #18070
XKEUYUOSYUMMLP-OVCLIPMQSA-N
- 1647010
MolClass #18071
YWICHOLVOTVAMW-UHFFFAOYSA-N
- 1776038
MolClass #18072
UZUYGYKYEKBAAZ-UHFFFAOYSA-N
- 1941678
MolClass #18073
NXNHUHCREPHAHV-POHAHGRESA-N
- 1949915
MolClass #18074
SCWAILPERVWDOP-UHFFFAOYSA-N
- 1643442
MolClass #18075
WITSYBNZXHHDIT-UHFFFAOYSA-N
- 1334112
MolClass #18076
MTSUMIHIRQJTPX-UHFFFAOYSA-N
- 1567575
MolClass #18077
HUNOZVPIASZIRL-UHFFFAOYSA-N
- 1942977
MolClass #18078
FVIGXDZGYSIKSZ-UHFFFAOYSA-N
- 1922564
MolClass #18079
GJJKCCBTWZRCFD-UHFFFAOYSA-N
- 1929243
MolClass #18080
VADGREXJRPRWRH-DUXPYHPUSA-N
- 1939711
MolClass #18081
KJRBPJGEPVNZFT-UHFFFAOYSA-N
- 2070105
MolClass #18082
DEMYTDOPBQDJHL-UHFFFAOYSA-N
- 1948972
MolClass #18083
APUHALOKKUVYAE-UHFFFAOYSA-N
- 1782953
MolClass #18084
HLOBWYYVANVHFI-UHFFFAOYSA-N
- 1726129
MolClass #18085
OUBJGKZYHXUUOH-UHFFFAOYSA-N
- 1922233
MolClass #18086
PHAXKMWEHYBPQC-UHFFFAOYSA-N
- 2070411
MolClass #18087
HXQAAZYGQGMZSJ-UHFFFAOYSA-N
- 1269670
MolClass #18088
HOUIPGYVDZZJNP-UHFFFAOYSA-N
- 1249448
MolClass #18089
MKVIELFIGZTWFL-UHFFFAOYSA-N
- 1941273
MolClass #18090
XGKYUPCIFJPQSM-MDZDMXLPSA-N
- 1123
MolClass #18091
SBDNJUWAMKYJOX-UHFFFAOYSA-N
- 1119277
MolClass #18092
YQXPNXFPFBBPAM-UHFFFAOYSA-N
- 1922985
MolClass #18093
FGHBFLJBDNXLIJ-VKAVYKQESA-N
- 1921017
MolClass #18094
FECKTPOVZVMFFA-UHFFFAOYSA-N
- 1972802
MolClass #18095
IZQHPDWJANCAFT-UHFFFAOYSA-N
- 3022967
MolClass #18096
YPJWLQQPLRXNSQ-UHFFFAOYSA-N
- 1987092
MolClass #18097
JXBPEWAUFRWNFW-UHFFFAOYSA-N
- 1976180
MolClass #18098
OWUODXVIRLENMT-UHFFFAOYSA-N
- 1935500
MolClass #18099
AGJJTJWXLQOFCJ-YBEGLDIGSA-N
- 1915476
MolClass #18100
OWKKEEBGSRMOJV-UHFFFAOYSA-N