Molecule directory
Explore structures, source datasets and saved model predictions for molecules registered in MolClass.
Search by molecule name, identifier or structure →- 299-75-2
MolClass #9001
YCPOZVAOBBQLRI-PHDIDXHHSA-N
- 2997-92-4
MolClass #9002
CCTFAOUOYLVUFG-BUHFOSPRSA-N
- 302-70-5
MolClass #9003
AFLXUQUGROGEFA-UHFFFAOYSA-N
- 316-42-7
MolClass #9004
AUVVAXYIELKVAI-CUVLDTKSSA-N
- 33069-62-4
MolClass #9005
RCINICONZNJXQF-TXKWARLASA-N
- 3311-98-6
MolClass #9006
SZVZATMROGWSLP-UHFFFAOYSA-N
- 3387-36-8
MolClass #9007
DJJCXFVJDGTHFX-CCXZUQQUSA-N
- 3414-62-8
MolClass #9008
QROZCFCNYCVEDO-KQYNXXCUSA-N
- 343-94-2
MolClass #9009
- 3546-10-9
MolClass #9010
SPJCRMJCFSJKDE-ZWBUGVOYSA-N
- 3546-41-6
MolClass #9011
WLJNZVDCPSBLRP-UHFFFAOYSA-N
- 362-74-3
MolClass #9012
CJGYSWNGNKCJSB-YVLZZHOMSA-N
- 379-79-3
MolClass #9013
- 3836-23-5
MolClass #9014
APTGJECXMIKIET-WOSSHHRXSA-N
- 40297-54-9
MolClass #9015
VAQMNFPQRLLRMG-LSCFUAHRSA-N
- 43000-65-3
MolClass #9016
JMZJBCNHUJOLER-AYQCGTONSA-N
- 4494-26-2
MolClass #9017
MVORBLZUGBSUNB-BWZBUEFSSA-N
- 4691-65-0
MolClass #9018
GRSZFWQUAKGDAV-KQYNXXCUSA-N
- 480-81-9
MolClass #9019
FCEVNJIUIMLVML-ZROSAYKKSA-N
- 4914-30-1
MolClass #9020
XXLZPUYGHQWHRN-RPBOFIJWSA-N
- 514-10-3
MolClass #9021
RSWGJHLUYNHPMX-RAUXBKROSA-N
- 528-53-0
MolClass #9022
JKHRCGUTYDNCLE-UHFFFAOYSA-O
- 5323-95-5
MolClass #9023
WBHHMMIMDMUBKC-GKUQOKNUSA-N
- 535-83-1
MolClass #9024
WWNNZCOKKKDOPX-UHFFFAOYSA-O
- 53956-04-0
MolClass #9025
LPLVUJXQOOQHMX-QWBHMCJMSA-N
- 5418-93-9
MolClass #9026
- 5461-85-8
MolClass #9027
SSNMTYTXJCMMSO-UHFFFAOYSA-N
- 548-42-5
MolClass #9028
- 5550-12-9
MolClass #9029
RQFCJASXJCIDSX-UUOKFMHZSA-N
- 569-26-6
MolClass #9030
- 58-19-5
MolClass #9031
IKXILDNPCZPPRV-FLOUHHNOSA-N
- 581-64-6
MolClass #9032
CBBMGBGDIPJEMI-UHFFFAOYSA-N
- 5858-81-1
MolClass #9033
JYNBEDVXQNFTOX-FMQUCBEESA-N
- 598-57-2
MolClass #9034
ARCZSDSOONGBRX-UHFFFAOYSA-N
- 60-57-1
MolClass #9035
DFBKLUNHFCTMDC-MZMCPKSGSA-N
- 6028-07-5
MolClass #9036
- 61-76-7
MolClass #9037
SONNWYBIRXJNDC-VIFPVBQESA-N
- 61-82-5
MolClass #9038
KLSJWNVTNUYHDU-UHFFFAOYSA-N
- 621-44-3
MolClass #9039
FBTSQILOGYXGMD-UHFFFAOYSA-N
- 6285-68-3
MolClass #9040
- 63166-73-4
MolClass #9041
VOTNXJVGRXZYOA-LZCPFWRZSA-N
- 633-03-4
MolClass #9042
HXCILVUBKWANLN-UHFFFAOYSA-N
- 64-75-5
MolClass #9043
OFVLGDICTFRJMM-FYHUAQAWSA-N
- 6428-31-5
MolClass #9044
YILRCDLYJGTFTH-SSBBCRENSA-N
- 6637-88-3
MolClass #9045
QYRKLZKJMKCVSE-HSBKYFPUSA-N
- 668-17-7
MolClass #9046
ZJBMQVPEJHVSQA-ICQCLVOWSA-N
- 67199-66-0
MolClass #9047
ZZOQRRWSDKBQQR-UHFFFAOYSA-N
- 69-74-9
MolClass #9048
UHDGCWIWMRVCDJ-CCXZUQQUSA-N
- 69245-38-1
MolClass #9049
GFEWKUPUJDGEKH-KBAYLFHDSA-N
- 70-18-8
MolClass #9050
RWSXRVCMGQZWBV-WDSKDSINSA-N
- 7570-86-7
MolClass #9051
UQGMJZQVDNZRKT-HUUCEWRRSA-N
- 79-92-5
MolClass #9052
CRPUJAZIXJMDBK-DTWKUNHWSA-N
- 90597-22-1
MolClass #9053
DUJGMZAICVPCBJ-VDAHYXPESA-N
- 106636-46-8
MolClass #9054
GKQREIUTZBDBND-UHFFFAOYSA-N
- 106671-90-3
MolClass #9055
ZPIAVZNPGIYODT-UHFFFAOYSA-N
- 135086-91-8
MolClass #9056
- 95152-79-7
MolClass #9057
AKGLPARAPSMXJV-UHFFFAOYSA-N
- 114451-08-0
MolClass #9058
JQICQDTZNZTBEZ-UHFFFAOYSA-N
- 16311-38-9
MolClass #9059
BRKUSHXUPGCTMP-UHFFFAOYSA-N
- 28166-06-5
MolClass #9060
VCTBSHQJICJJFV-UHFFFAOYSA-N
- 98046-75-4
MolClass #9061
RMBFLFDSKVVMBP-UHFFFAOYSA-N
- 98046-74-3
MolClass #9062
OXSJVKQHQFJVPL-UHFFFAOYSA-N
- 98151-91-8
MolClass #9063
DDTKLIBTCCSFGT-OXJNMPFZSA-N
- 97576-08-4
MolClass #9064
WDHBKPKURFBUFF-YLJYHZDGSA-N
- 111070-55-4
MolClass #9065
DQXWSAXEIGMNAX-UXBLZVDNSA-N
- 117760-92-6
MolClass #9066
FIVHJEBACQSOKY-AEFFLSMTSA-N
- 101043-65-6
MolClass #9067
WWKLDZDOXNNLAM-UHFFFAOYSA-N
- 100593-23-5
MolClass #9068
PAJDGJYLNJGDDA-UHFFFAOYSA-N
- 24400-01-9
MolClass #9069
OTZKWZWFTBATFL-UHFFFAOYSA-N
- 116374-67-5
MolClass #9070
QPWBTZNSNJXXSU-UHFFFAOYSA-N
- 101688-02-2
MolClass #9071
BEYPOADXXCEGDU-UHFFFAOYSA-N
- 109143-18-2
MolClass #9072
VJRUOWDUVMMWOO-UHFFFAOYSA-N
- 109143-20-6
MolClass #9073
YVTVKGADNTVFRY-UHFFFAOYSA-N
- 3025-77-2
MolClass #9074
VERRKUAVICFWGH-VHEBQXMUSA-N
- 133591-35-2
MolClass #9075
- 129018-59-3
MolClass #9076
YOWIYVXZLOSSJZ-UHFFFAOYSA-N
- 138835-34-4
MolClass #9077
VUABPVGKRFXVOR-UHFFFAOYSA-N
- 138835-33-3
MolClass #9078
VPZIZDPGGWCVSW-UHFFFAOYSA-N
- 97509-27-8
MolClass #9079
VNOVNHOBHYKYND-TZMCWYRMSA-N
- 116374-66-4
MolClass #9080
KJZXYAAANXOWCW-UHFFFAOYSA-N
- 25799-70-6
MolClass #9081
FECAGPZNMVGWPG-UHFFFAOYSA-N
- 96918-17-1
MolClass #9082
VEKWHWNJPFDOBV-UHFFFAOYSA-N
- 133591-33-0
MolClass #9083
- Lupitidine
MolClass #9084
- Icotidine
MolClass #9085
- 35
MolClass #9086
NHGAJMORWUZRDS-QGZVFWFLSA-N
- Cimetidine
MolClass #9087
- 1-47
MolClass #9088
CSIVCTHRYRVJCI-UHFFFAOYSA-N
- Didanosine
MolClass #9089
BXZVVICBKDXVGW-NKWVEPMBSA-N
- Ranitidine
MolClass #9090
RFDSZAFRLNDRMB-UKTHLTGXSA-N
- L-663581
MolClass #9091
SEWXZWMBVGJJPG-UHFFFAOYSA-N
- Hydroxyzine
MolClass #9092
ZQDWXGKKHFNSQK-OAQYLSRUSA-N
- Allopurinol
MolClass #9093
- Temelastine
MolClass #9094
- Domperidone
MolClass #9095
- Tibolone
MolClass #9096
WZDGZWOAQTVYBX-XOINTXKNSA-N
- Tiotidine
MolClass #9097
YDDXVAXDYKBWDX-UHFFFAOYSA-N
- Theophylline
MolClass #9098
- 2-methylpentane
MolClass #9099
AFABGHUZZDYHJO-UHFFFAOYSA-N
- 3-methylhexane
MolClass #9100
VLJXXKKOSFGPHI-SSDOTTSWSA-N