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Ligand

NameCHEMBL2348469
Molecular formulaC27H36O3
IUPAC name2-[(6aR,9S,10aR)-3-(1-adamantyl)-1-hydroxy-6,6-dimethyl-6a,7,8,9,10,10a-hexahydrobenzo[c]chromen-9-yl]acetaldehyde
Molecular weight408.582
Hydrogen bond acceptor3
Hydrogen bond donor1
XlogP6.5
SynonymsBDBM50432720
Inchi KeyCGQWUYOPAIRUAK-RRLKHSHUSA-N
Inchi IDInChI=1S/C27H36O3/c1-26(2)22-4-3-16(5-6-28)10-21(22)25-23(29)11-20(12-24(25)30-26)27-13-17-7-18(14-27)9-19(8-17)15-27/h6,11-12,16-19,21-22,29H,3-5,7-10,13-15H2,1-2H3/t16-,17?,18?,19?,21-,22-,27?/m1/s1
PubChem CID71661891
ChEMBLCHEMBL2348469
IUPHARN/A
BindingDB50432720
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: 3
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
41553Cannabinoid receptor 1P20272Cnr1Rattus norvegicus (Rat)473
41552Cannabinoid receptor 2P47936Cnr2Mus musculus (Mouse)347
41554Cannabinoid receptor 2P34972CNR2Homo sapiens (Human)360

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