CHEMBL363840


SMILES Cn1nnnc1-c1cccc(NC(=O)N[C@@H]2CCCC[C@H]2CN2CCC[C@@H](Cc3ccc(F)cc3)C2)c1
InChIKey HEXTXRMVMKIBQR-RZPFDVGOSA-N

Chemical properties

Hydrogen bond acceptors 6
Hydrogen bond donors 2
Rotatable bonds 7
Molecular weight (Da) 505.3

Drug properties

Molecular type Small molecule
Endogenous/Surrogate Surrogate
Approved drug No

Database connections

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
CCR3 CCR3 Rat Chemokine A pIC50 11.0 11.0 11.0 ChEMBL
CCR3 CCR3 Mouse Chemokine A pIC50 7.7 7.7 7.7 ChEMBL
CCR3 CCR3 Human Chemokine A pIC50 8.7 9.86 11.0 ChEMBL
CCR1 CCR1 Human Chemokine A pIC50 5.0 5.0 5.0 ChEMBL
CXCR1 CXCR1 Human Chemokine A pIC50 5.0 5.0 5.0 ChEMBL
CXCR2 CXCR2 Human Chemokine A pIC50 5.0 5.0 5.0 ChEMBL
CCR2 CCR2 Human Chemokine A pIC50 5.0 5.0 5.0 ChEMBL
CCR5 CCR5 Human Chemokine A pIC50 6.0 6.0 6.0 ChEMBL