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Ligand

NameCHEMBL401868
Molecular formulaC31H27Cl2N5O2
IUPAC nameN-[3-[7-chloro-3-[2-(4-chlorophenyl)-2-oxoethyl]-2-iminobenzimidazol-1-yl]propyl]-N-cyclopropylquinoline-8-carboxamide
Molecular weight572.49
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP6.0
SynonymsBDBM50375119
Inchi KeyUCPBQJPEROOMRS-UHFFFAOYSA-N
Inchi IDInChI=1S/C31H27Cl2N5O2/c32-22-12-10-20(11-13-22)27(39)19-38-26-9-2-8-25(33)29(26)37(31(38)34)18-4-17-36(23-14-15-23)30(40)24-7-1-5-21-6-3-16-35-28(21)24/h1-3,5-13,16,23,34H,4,14-15,17-19H2
PubChem CID44453468
ChEMBLCHEMBL401868
IUPHARN/A
BindingDB50375119
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: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
333582C-X-C chemokine receptor type 3O88410Cxcr3Mus musculus (Mouse)367
333583C-X-C chemokine receptor type 3P49682CXCR3Homo sapiens (Human)368

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