Molecule directory
Explore structures, source datasets and saved model predictions for molecules registered in MolClass.
Search by molecule name, identifier or structure →- 22401981
MolClass #38001
PCWVEYULDCMBMK-UHFFFAOYSA-N
- 24820859
MolClass #38002
XWFWFCARCCQLSU-UHFFFAOYSA-N
- 843390
MolClass #38003
UXIVMKYPOVSJEH-UHFFFAOYSA-N
- 22401829
MolClass #38004
ODMKKRILABMFFK-CGOBSMCZSA-N
- 24813256
MolClass #38005
- 22413467
MolClass #38006
RMPGZGWQIXKLNC-UHFFFAOYSA-N
- 22411598
MolClass #38007
HZLGYZVGKCVXBM-UHFFFAOYSA-N
- 24784119
MolClass #38008
YGAXOMXVAAPJNR-UHFFFAOYSA-N
- 24814518
MolClass #38009
JNUCJGIZYXZFRX-UHFFFAOYSA-N
- 17512829
MolClass #38010
WTBRDNABGOHCQO-UHFFFAOYSA-N
- 17407346
MolClass #38011
OERNYXSSDXOMLH-OOJLDXBWSA-N
- 24798729
MolClass #38012
QUGWVBLHJWELDV-UHFFFAOYSA-N
- 7965560
MolClass #38013
AQXJFHKCXZSEEY-UHFFFAOYSA-N
- 24819880
MolClass #38014
LVJKNCGAXLDSGQ-UHFFFAOYSA-N
- 17506197
MolClass #38015
VXQNNTLJMJDESO-UHFFFAOYSA-N
- 17401619
MolClass #38016
RFGMDOCXGCLNGA-PHSHQRSZSA-M
- 865277
MolClass #38017
YNMVLODCFQMDAI-UHFFFAOYSA-N
- 22412989
MolClass #38018
TYFSGHQDPBJVHZ-UHFFFAOYSA-N
- 859426
MolClass #38019
LFYJRTPWFKOCTC-VHSXEESVSA-N
- 865090
MolClass #38020
ZDUPMKPVDRTDCV-UHFFFAOYSA-N
- 24804214
MolClass #38021
FHGPDUQVFWQLFK-UHFFFAOYSA-N
- 24840663
MolClass #38022
- 24797667
MolClass #38023
SFAPTPOQQNHNGG-UHFFFAOYSA-N
- 24818734
MolClass #38024
STTFMIKZFVMWJL-OVCLIPMQSA-N
- 14744734
MolClass #38025
- 7968189
MolClass #38026
LTMBNUJBWYAUOK-UHFFFAOYSA-N
- 4247839
MolClass #38027
VAAFWMASRDVMQF-UHFFFAOYSA-N
- 17513156
MolClass #38028
RPCLVUBVBHGMCS-UHFFFAOYSA-N
- 24820503
MolClass #38029
RHQJHHQYHBXODM-UHFFFAOYSA-N
- 3716470
MolClass #38030
JTYFUNWYLQZNBQ-UHFFFAOYSA-N
- 17407022
MolClass #38031
ITZISJJTUNFAFL-UHFFFAOYSA-N
- 4262607
MolClass #38032
XSDKNOYDEMFNSY-UHFFFAOYSA-N
- 24797862
MolClass #38033
UAHVPWKJJQAKJM-UHFFFAOYSA-N
- 7977798
MolClass #38034
KDKRMLDEGWORKL-NTMALXAHSA-N
- 4250506
MolClass #38035
- 4240823
MolClass #38036
- 14731043
MolClass #38037
CTNQJSCSMAOUCZ-UHFFFAOYSA-N
- 14723934
MolClass #38038
IVSMYCAEYJVVAD-UHFFFAOYSA-N
- 858555
MolClass #38039
LAPWMKGSGLMNJI-UHFFFAOYSA-N
- 859208
MolClass #38040
- 14732388
MolClass #38041
VFGUDQWXXLJHCZ-UHFFFAOYSA-N
- 3713810
MolClass #38042
QWNWPEYTWPYOGT-UHFFFAOYSA-N
- 7965540
MolClass #38043
NCOIMZZTFNABAS-UHFFFAOYSA-N
- 7971463
MolClass #38044
OBCTUTOUGBMEOK-UHFFFAOYSA-N
- 24780156
MolClass #38045
SGVFMDDLTSECGE-UHFFFAOYSA-N
- 17516546
MolClass #38046
OWXCZTVZJXKGDK-UHFFFAOYSA-N
- 17433506
MolClass #38047
IGMOUVMIKURCBR-UHFFFAOYSA-N
- 24824015
MolClass #38048
RBESARLEHBAMKN-UHFFFAOYSA-N
- 24805559
MolClass #38049
BPFJOQLHZZQXKA-UHFFFAOYSA-N
- 4245597
MolClass #38050
JYXKSLQGTFWYIY-UHFFFAOYSA-N
- 24811337
MolClass #38051
XPFMBPZXBGQIIM-UHFFFAOYSA-N
- 22413139
MolClass #38052
WMUKAHNPYSDUKX-UHFFFAOYSA-N
- 4252036
MolClass #38053
BAOSEPHEMSBKSA-UHFFFAOYSA-N
- 859516
MolClass #38054
PMERKZFUHYVPRN-UHFFFAOYSA-N
- 7975366
MolClass #38055
SUNMLPVOEXPESO-UHFFFAOYSA-N
- 17409401
MolClass #38056
WGAWPEDAJWIZPM-UHFFFAOYSA-N
- 24824980
MolClass #38057
RCIKLJLCEILQRK-UHFFFAOYSA-N
- 14728902
MolClass #38058
FGEFZWAZRNQNCU-UHFFFAOYSA-N
- 845746
MolClass #38059
YPIZITNNUSTRMY-UHFFFAOYSA-N
- 24803618
MolClass #38060
ISVDOQDQNFFEEF-UHFFFAOYSA-N
- 4254992
MolClass #38061
GTRWBCRNNYLZNQ-UHFFFAOYSA-N
- 24826776
MolClass #38062
MUHACUBZFCDWKV-UHFFFAOYSA-N
- 22402667
MolClass #38063
BGTMMDAQGIKLGM-UHFFFAOYSA-N
- 22414205
MolClass #38064
XGABNDVDMQXJKB-UHFFFAOYSA-N
- 24821714
MolClass #38065
YBUJLROLUVVIRU-UHFFFAOYSA-N
- 24819119
MolClass #38066
WKQYCYIBTQRMTP-UHFFFAOYSA-N
- 865560
MolClass #38067
IPAHKONPBMELQU-UHFFFAOYSA-N
- 17401676
MolClass #38068
HBGZHONGRRAFMI-UHFFFAOYSA-N
- 17407233
MolClass #38069
VECSNXXUTGLSNQ-OOJLDXBWSA-N
- 17387071
MolClass #38070
CSEJZCOHPYDFLM-UHFFFAOYSA-N
- 17508271
MolClass #38071
CIEPKKMXGPILDI-UHFFFAOYSA-N
- 24834648
MolClass #38072
HYELDGUNYOPEMH-UHFFFAOYSA-N
- 22404972
MolClass #38073
IBDBVEYUXOTRAO-UHFFFAOYSA-N
- 17403192
MolClass #38074
LFFTURASAAMAHJ-ONNFQVAWSA-N
- 24819170
MolClass #38075
URKAPRSDRFNYCG-UHFFFAOYSA-N
- 7964665
MolClass #38076
CWYDCRJQKAYFQB-UHFFFAOYSA-N
- 4265749
MolClass #38077
ZTYIJDOUCJVFIT-UHFFFAOYSA-N
- 17406987
MolClass #38078
JXOIQXOMHOCFAO-UHFFFAOYSA-N
- 24707945
MolClass #38079
DYFHYFBYTNLOBT-QWRGUYRKSA-N
- 24780176
MolClass #38080
- 24779317
MolClass #38081
BESVHONPPDCMCM-JXMROGBWSA-N
- 4251251
MolClass #38082
- 24840445
MolClass #38083
BRCFZLHPGDQFNJ-UHFFFAOYSA-N
- 855920
MolClass #38084
LTLYEAJONXGNFG-HBNTYKKESA-N
- 7971429
MolClass #38085
SGAPBLVHCYMHCF-UHFFFAOYSA-N
- 24799484
MolClass #38086
KKPANKSVQSMIKU-UHFFFAOYSA-N
- 24798400
MolClass #38087
OAOPRFDBTUADNO-UHFFFAOYSA-N
- 3714181
MolClass #38088
ZYQDQCQYVMWGED-UHFFFAOYSA-N
- 14728276
MolClass #38089
- 4247088
MolClass #38090
BDHGLBTVQJOTFI-UHFFFAOYSA-N
- 22412621
MolClass #38091
YEVIBJWQJLICSC-UHFFFAOYSA-N
- 24798966
MolClass #38092
JEXYGSJZTXPLIZ-CYVLTUHYSA-N
- 14736461
MolClass #38093
FVXAAVIYAFHSTB-UHFFFAOYSA-N
- 17408106
MolClass #38094
QQMVXUYSDBXPIN-UHFFFAOYSA-N
- 17402781
MolClass #38095
WTRRGKLODXSCQG-UHFFFAOYSA-N
- 24799471
MolClass #38096
OFXXBNQORFRNFR-UHFFFAOYSA-N
- 3715838
MolClass #38097
- 24827669
MolClass #38098
URAPOSTVLFMLTB-UHFFFAOYSA-N
- 24785360
MolClass #38099
- 24823833
MolClass #38100