BMS-741672


SMILES CC(=O)N[C@@H]1C[C@@H](CC[C@@H]1N1CC[C@@H](C1=O)Nc1ncnc2c1cc(cc2)C(F)(F)F)N(C(C)C)C
InChIKey GVOISEJVFFIGQE-YCZSINBZSA-N

Chemical properties

Hydrogen bond acceptors 6
Hydrogen bond donors 2
Rotatable bonds 6
Molecular weight (Da) 506.3

Drug properties

Molecular type Small molecule
Physiological/Surrogate Surrogate
Approved drug No

Database connections

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
CCR5 CCR5 Human Chemokine A pKd 7.63 7.63 7.63 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
CCR2 CCR2 Human Chemokine A pIC50 8.96 8.96 8.96 Guide to Pharmacology
CCR5 CCR5 Human Chemokine A pIC50 6.11 6.11 6.11 Guide to Pharmacology
CCR2 CCR2 Human Chemokine A pIC50 8.85 9.04 9.17 ChEMBL
CCR5 CCR5 Human Chemokine A pIC50 6.11 6.11 6.11 ChEMBL