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Ligand

NameCHEMBL59540
Molecular formulaC25H36O3
IUPAC name(6aR,10aR)-1-hydroxy-6,6-dimethyl-3-(2-methyloctan-2-yl)-6a,7,10,10a-tetrahydrobenzo[c]chromene-9-carbaldehyde
Molecular weight384.56
Hydrogen bond acceptor3
Hydrogen bond donor1
XlogP7.0
SynonymsBDBM50287930
(6aR,10aR)-3-(1,1-Dimethyl-heptyl)-1-hydroxy-6,6-dimethyl-6a,7,10,10a-tetrahydro-6H-benzo[c]chromene-9-carbaldehyde
Inchi KeyAARQDCQBCMFBPF-WOJBJXKFSA-N
Inchi IDInChI=1S/C25H36O3/c1-6-7-8-9-12-24(2,3)18-14-21(27)23-19-13-17(16-26)10-11-20(19)25(4,5)28-22(23)15-18/h10,14-16,19-20,27H,6-9,11-13H2,1-5H3/t19-,20-/m1/s1
PubChem CID15000083
ChEMBLCHEMBL59540
IUPHARN/A
BindingDB50287930
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: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
467Cannabinoid receptor 1P21554CNR1Homo sapiens (Human)472
466Cannabinoid receptor 2P34972CNR2Homo sapiens (Human)360

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