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Ligand

NameCHEMBL470431
Molecular formulaC24H34ClFN2
IUPAC name1-[(4-chloro-2-fluorophenyl)methyl]-N-(5,7-dimethyl-2-adamantyl)piperidin-4-amine
Molecular weight404.998
Hydrogen bond acceptor3
Hydrogen bond donor1
XlogP5.8
SynonymsBDBM50413573
Inchi KeyBGSDICWSHGFKQU-UHFFFAOYSA-N
Inchi IDInChI=1S/C24H34ClFN2/c1-23-10-17-12-24(2,15-23)13-18(11-23)22(17)27-20-5-7-28(8-6-20)14-16-3-4-19(25)9-21(16)26/h3-4,9,17-18,20,22,27H,5-8,10-15H2,1-2H3
PubChem CID44592267
ChEMBLCHEMBL470431
IUPHARN/A
BindingDB50413573
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: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
23383C-X-C chemokine receptor type 3P49682CXCR3Homo sapiens (Human)368

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