CHEMBL472288


SMILES CCNC(=O)c1cnc(N2CCN(C3CCN(Cc4ccc(Cl)cc4)CC3)[C@@H](CC)C2)c(Cl)c1
InChIKey XQWKNLJIWOTOKT-QFIPXVFZSA-N

Chemical properties

Hydrogen bond acceptors 5
Hydrogen bond donors 1
Rotatable bonds 7
Molecular weight (Da) 503.2

Drug properties

Molecular type Small molecule
Physiological/Surrogate Surrogate
Approved drug No

Database connections

Ligand site mutations CXCR3

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
CXCR3 CXCR3 Human Chemokine A pKi 8.5 8.5 8.5 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
CXCR3 CXCR3 Rat Chemokine A pIC50 8.92 8.92 8.92 ChEMBL
CXCR3 CXCR3 Mouse Chemokine A pIC50 9.3 9.3 9.3 ChEMBL
CXCR3 CXCR3 Human Chemokine A pIC50 7.8 8.66 9.52 ChEMBL