cenicriviroc


SMILES CCCCOCCOc1ccc(cc1)c1ccc2c(c1)C=C(CCCN2CC(C)C)C(=O)Nc1ccc(cc1)[S@@](=O)Cc1cncn1CCC
InChIKey PNDKCRDVVKJPKG-DPDRHGIRSA-N

Chemical properties

Hydrogen bond acceptors 7
Hydrogen bond donors 1
Rotatable bonds 17
Molecular weight (Da) 696.4

Drug properties

Molecular type Small molecule
Physiological/Surrogate Surrogate
Approved drug Yes

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
CCR5 CCR5 Human Chemokine A pIC50 8.6 8.6 8.6 Guide to Pharmacology
CCR7 CCR7 Human Chemokine A pIC50 8.51 8.51 8.51 ChEMBL
CCR5 CCR5 Mouse Chemokine A pIC50 9.6 9.6 9.6 ChEMBL
CCR2 CCR2 Human Chemokine A pIC50 8.23 8.23 8.23 ChEMBL
CCR3 CCR3 Human Chemokine A pIC50 5.62 5.62 5.62 ChEMBL
CCR4 CCR4 Human Chemokine A pIC50 5.96 5.96 5.96 ChEMBL
CCR5 CCR5 Human Chemokine A pIC50 8.51 9.18 10.0 ChEMBL