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Ligand

NameCHEMBL1209670
Molecular formulaC27H26ClF3N2O2
IUPAC name1-[3-[(4-chlorophenyl)methyl]-3-phenylpyrrolidin-1-yl]-2-methyl-2-[5-(trifluoromethyl)pyridin-2-yl]oxypropan-1-one
Molecular weight502.962
Hydrogen bond acceptor6
Hydrogen bond donor0
XlogP6.6
SynonymsBDBM50323612
(+/-)-1-(3-(4-chlorobenzyl)-3-phenylpyrrolidin-1-yl)-2-methyl-2-(5-(trifluoromethyl)pyridin-2-yloxy)propan-1-one
Inchi KeyAHIGFBNAPKVCDM-UHFFFAOYSA-N
Inchi IDInChI=1S/C27H26ClF3N2O2/c1-25(2,35-23-13-10-21(17-32-23)27(29,30)31)24(34)33-15-14-26(18-33,20-6-4-3-5-7-20)16-19-8-11-22(28)12-9-19/h3-13,17H,14-16,18H2,1-2H3
PubChem CID49862640
ChEMBLCHEMBL1209670
IUPHARN/A
BindingDB50323612
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.
This ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
5570Cannabinoid receptor 1P21554CNR1Homo sapiens (Human)472

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