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Ligand

NameCHEMBL108868
Molecular formulaC27H40O2
IUPAC name(6aR,10aR)-3-(1-hexylcyclopentyl)-6,6,9-trimethyl-6a,7,10,10a-tetrahydrobenzo[c]chromen-1-ol
Molecular weight396.615
Hydrogen bond acceptor2
Hydrogen bond donor1
XlogP8.6
SynonymsBDBM50130623
3-(1-Hexyl-cyclopentyl)-6,6,9-trimethyl-6a,7,10,10a-tetrahydro-6H-benzo[c]chromen-1-ol
(6ar)-(trans)-3-(1-hexylcyclopentyl)-6a,7,10,10a-tetrahydro-6,6,9-trimethyl-6h-dibenzo[b,d]pyran-1-ol
(6aR,10aR)-3-(1-hexylcyclopentyl)-6,6,9-trimethyl-6a,7,10,10a-tetrahydro-6H-benzo[c]chromen-1-ol
Inchi KeyFONCHEGPDSYFCG-FGZHOGPDSA-N
Inchi IDInChI=1S/C27H40O2/c1-5-6-7-8-13-27(14-9-10-15-27)20-17-23(28)25-21-16-19(2)11-12-22(21)26(3,4)29-24(25)18-20/h11,17-18,21-22,28H,5-10,12-16H2,1-4H3/t21-,22-/m1/s1
PubChem CID10982174
ChEMBLCHEMBL108868
IUPHARN/A
BindingDB50130623
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 4
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
83414Cannabinoid receptor 1P20272Cnr1Rattus norvegicus (Rat)473
83415Cannabinoid receptor 1P21554CNR1Homo sapiens (Human)472
83413Cannabinoid receptor 2P34972CNR2Homo sapiens (Human)360
83416Cannabinoid receptor 2P47936Cnr2Mus musculus (Mouse)347

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