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Ligand

NameCHEMBL427833
Molecular formulaC29H25Cl2N5O2
IUPAC nameN-[3-[7-chloro-3-[2-(4-chlorophenyl)-2-oxoethyl]-2-iminobenzimidazol-1-yl]propyl]-N-methylquinoline-8-carboxamide
Molecular weight546.452
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP5.5
SynonymsBDBM50375122
SCHEMBL14373234
Inchi KeyXYQSDKPJILDTCY-UHFFFAOYSA-N
Inchi IDInChI=1S/C29H25Cl2N5O2/c1-34(28(38)22-8-2-6-20-7-4-15-33-26(20)22)16-5-17-35-27-23(31)9-3-10-24(27)36(29(35)32)18-25(37)19-11-13-21(30)14-12-19/h2-4,6-15,32H,5,16-18H2,1H3
PubChem CID44453585
ChEMBLCHEMBL427833
IUPHARN/A
BindingDB50375122
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
404097C-X-C chemokine receptor type 3O88410Cxcr3Mus musculus (Mouse)367
404098C-X-C chemokine receptor type 3P49682CXCR3Homo sapiens (Human)368

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