Molecule directory
Explore structures, source datasets and saved model predictions for molecules registered in MolClass.
Search by molecule name, identifier or structure →- 24787546
MolClass #45001
BQQIHAGUYKMXAT-UHFFFAOYSA-N
- 22416985
MolClass #45002
VDUYGFTYAXNXLA-UHFFFAOYSA-N
- 24825810
MolClass #45003
GBCFGQRWTQEHRA-UHFFFAOYSA-N
- 14742377
MolClass #45004
HSQSGIPRWNRTCY-OTQHQDGKSA-N
- 4243383
MolClass #45005
DXDHCNAJXKSPND-UHFFFAOYSA-N
- 14740792
MolClass #45006
IXASHMYQZGCHIA-HYARGMPZSA-N
- 859129
MolClass #45007
GDOJPMUOAJGGKL-UHFFFAOYSA-N
- 4250116
MolClass #45008
- 4250291
MolClass #45009
SDWMGHBSFMPKNK-UHFFFAOYSA-N
- 24790550
MolClass #45010
IPSWKGQPGCYNLS-UHFFFAOYSA-N
- 24831812
MolClass #45011
MENRJWVRGJKCQR-UHFFFAOYSA-N
- 17388537
MolClass #45012
CPUOGYZOOLSTPH-UHFFFAOYSA-N
- 864956
MolClass #45013
PWOCMFZIMZKXHI-UHFFFAOYSA-N
- 24788036
MolClass #45014
CHGIZUQZOOIUTL-UHFFFAOYSA-N
- 17412120
MolClass #45015
BXEOZHQTYFFOSS-UHFFFAOYSA-N
- 4254487
MolClass #45016
IVBVNCLHSRBQBU-UHFFFAOYSA-N
- 24781502
MolClass #45017
- 22404703
MolClass #45018
NMWCULIGMOKBRG-ZBFHGGJFSA-N
- 24800575
MolClass #45019
UZKIKGTVAOTVIO-UHFFFAOYSA-N
- 7971542
MolClass #45020
ZUAMMHYNGMEMGE-UHFFFAOYSA-N
- 848509
MolClass #45021
XJJBSQQXRVIITG-UHFFFAOYSA-N
- 14724791
MolClass #45022
QLRBEASDNQIIFH-UHFFFAOYSA-N
- 24800567
MolClass #45023
LGIAHKLWGHEYNX-UHFFFAOYSA-N
- 17410071
MolClass #45024
XZYXUWGCCNEUHX-UHFFFAOYSA-N
- 17407889
MolClass #45025
MHMRCQPNANOZCN-UHFFFAOYSA-N
- 856754
MolClass #45026
AVTVGYRYHXSOLA-UHFFFAOYSA-N
- 17402431
MolClass #45027
IOARIYKAASODPP-UHFFFAOYSA-N
- 864763
MolClass #45028
AJQQANMDVBMWRE-UHFFFAOYSA-N
- 14733827
MolClass #45029
XGZYMUFQBAFOFS-UHFFFAOYSA-N
- 4246219
MolClass #45030
YTJAVXWZTLORKR-UHFFFAOYSA-N
- 14721730
MolClass #45031
KPRMUMMTTWEGJX-UHFFFAOYSA-N
- 4244923
MolClass #45032
CRYXAAVTCSNUTR-UHFFFAOYSA-N
- 24833425
MolClass #45033
WWZCODUPNAXHPZ-UHFFFAOYSA-N
- 844185
MolClass #45034
DBTCFOCNRVVZEI-UHFFFAOYSA-N
- 22409758
MolClass #45035
GRBAGENCTAKSBH-UHFFFAOYSA-N
- 17387895
MolClass #45036
NHUYCBRYMJLFKD-VXLYETTFSA-N
- 17515508
MolClass #45037
KEWKQMPBIYUBQU-UHFFFAOYSA-N
- 17414404
MolClass #45038
- 24833784
MolClass #45039
VTNHRKQUJURHRO-UHFFFAOYSA-N
- 24829391
MolClass #45040
PIXOIYKKEFLCEG-UHFFFAOYSA-N
- 14735550
MolClass #45041
- 22411666
MolClass #45042
WLHRFLMUOQKUQF-UHFFFAOYSA-N
- 4250757
MolClass #45043
KPZXSMXLBZMPHW-UHFFFAOYSA-N
- 24783008
MolClass #45044
CMIAJUISSSRBCW-UHFFFAOYSA-N
- 856561
MolClass #45045
NVIAPZFUWYGLTK-UHFFFAOYSA-N
- 7966364
MolClass #45046
- 17503983
MolClass #45047
- 17505036
MolClass #45048
SKIUFFVGBXNDNP-UHFFFAOYSA-N
- 863353
MolClass #45049
YTSHXJRXICEGKH-UHFFFAOYSA-N
- 4250443
MolClass #45050
SDFOAZKSFMKURE-UHFFFAOYSA-N
- 17407477
MolClass #45051
GNWYQOUTBAIIPR-UHFFFAOYSA-N
- 24816121
MolClass #45052
VMPMUWDMXTUNEJ-UHFFFAOYSA-N
- 17516163
MolClass #45053
CUQUHBIPXJNCAZ-UHFFFAOYSA-N
- 17410670
MolClass #45054
QBWJJOOWWDOEMX-UHFFFAOYSA-N
- 22404876
MolClass #45055
LHIXRJPHIMXKHP-UHFFFAOYSA-N
- 24800613
MolClass #45056
WWHHXFYDQMUALG-UHFFFAOYSA-N
- 24800405
MolClass #45057
RNRNFMNYICAGDP-UHFFFAOYSA-N
- 24785161
MolClass #45058
BTZHLWYAQCDJHZ-UHFFFAOYSA-N
- 14741273
MolClass #45059
ZGIAVNDKPDSLIA-UHFFFAOYSA-N
- 846542
MolClass #45060
CWTNSTKQFIFRKH-UHFFFAOYSA-N
- 14729963
MolClass #45061
QDMPSMVTOCCVGU-UHFFFAOYSA-N
- 26719799
MolClass #45062
IDZASIQMRGPBCQ-UHFFFAOYSA-N
- 24791186
MolClass #45063
JYGFJAIEAMRPNW-UHFFFAOYSA-N
- 17415608
MolClass #45064
BHVVAZOKOPLDSH-UHFFFAOYSA-N
- 14737027
MolClass #45065
LHZKRSHXEPTXBG-UHFFFAOYSA-N
- 24800121
MolClass #45066
LNYFGPHXFSRLLQ-UHFFFAOYSA-N
- 14739407
MolClass #45067
KZHZSMWJRCBHFP-UHFFFAOYSA-N
- 4241271
MolClass #45068
PTFDOLWJHKUXFE-UHFFFAOYSA-N
- 22404384
MolClass #45069
VZMIMONWQGIZIP-XDHOZWIPSA-N
- 24813917
MolClass #45070
NQMNTDNUBVEXTO-UHFFFAOYSA-N
- 17512973
MolClass #45071
KPIUDNAPQRCVPC-JMIUGGIZSA-N
- 24799116
MolClass #45072
GJQFKRNCJGQMFA-UHFFFAOYSA-N
- 859830
MolClass #45073
FIPPKLFENJETRI-UHFFFAOYSA-N
- 17408994
MolClass #45074
IAXVDXYESYNAMS-UHFFFAOYSA-N
- 7964567
MolClass #45075
JQSHFTSOVIGTDU-UHFFFAOYSA-N
- 3713336
MolClass #45076
PCKQRRYQJKRHIT-UHFFFAOYSA-N
- 4252321
MolClass #45077
YRSSTLGWFXJUEG-UHFFFAOYSA-N
- 7975678
MolClass #45078
WBAMGZSSYGJFAC-UHFFFAOYSA-N
- 24803571
MolClass #45079
JIMUPMLIZHOIBL-KPUGQTCVSA-N
- 24790831
MolClass #45080
VRCCVTLTIUYXHQ-UHFFFAOYSA-N
- 24822816
MolClass #45081
FKDUGTDVNUGXEC-UHFFFAOYSA-N
- 22413771
MolClass #45082
- 24800188
MolClass #45083
ZWILOASDIIAYAJ-UHFFFAOYSA-N
- 848979
MolClass #45084
UPQDLFOPXBYXMV-UHFFFAOYSA-N
- 22401506
MolClass #45085
ZNMWSWKDSXGIKF-UHFFFAOYSA-N
- 17401838
MolClass #45086
- 17510610
MolClass #45087
ZJZYNORWRUFCMG-UHFFFAOYSA-N
- 14732195
MolClass #45088
SDSOMZDHRWCFFP-UHFFFAOYSA-N
- 17388132
MolClass #45089
CCNCNPDCPOSHTA-UHFFFAOYSA-N
- 843922
MolClass #45090
LDKVGSIOGNQQRN-UHFFFAOYSA-N
- 4245103
MolClass #45091
KNFSUSDYHKUATK-UHFFFAOYSA-N
- 7975708
MolClass #45092
YZFUHTPFQMYVRS-UHFFFAOYSA-N
- 24799785
MolClass #45093
FUUAYAJQIUCKDB-UHFFFAOYSA-N
- 864365
MolClass #45094
AYPOGAKWEVZOEN-UHFFFAOYSA-N
- 24813919
MolClass #45095
KRUIGCCBHKYYDD-UHFFFAOYSA-N
- 24798597
MolClass #45096
ZAMPGBUOYPFEPA-UHFFFAOYSA-N
- 24813871
MolClass #45097
PUQTXJRFLBMLCT-UHFFFAOYSA-N
- 22414418
MolClass #45098
SVGMRVVIZBAFNB-UHFFFAOYSA-N
- 861042
MolClass #45099
- 3714175
MolClass #45100
HYMVRLWIIVVESI-UHFFFAOYSA-N