FR190997


SMILES CNC(=O)c1ccc(cc1)/C=C/C(=O)NCC(=O)N(c1ccc(c(c1Cl)COc1cccc2c1nc(C)cc2OCc1ccccn1)Cl)C
InChIKey YFMDLMSUZMRKKH-SFQUDFHCSA-N

Chemical properties

Hydrogen bond acceptors 7
Hydrogen bond donors 2
Rotatable bonds 12
Molecular weight (Da) 697.2

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
CCR1 CCR1 Human Chemokine A pKi 8.43 8.43 8.43 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
CCR1 CCR1 Human Chemokine A pIC50 9.0 9.0 9.0 Guide to Pharmacology
CCR1 Q2V0Q7 Dog Chemokine A pIC50 6.2 6.2 6.2 ChEMBL
CCR1 CCR1 Human Chemokine A pIC50 7.38 8.23 9.0 ChEMBL