VPC32179


SMILES CCCCCCCC/C=C\CCCCCCCC(=O)N[C@H](Cc1ccc(cc1)OCc1ccccn1)COP(=O)(O)[O-].[NH4+]
InChIKey CIWOPVRNKVCACF-FJRCUGBNSA-N

Chemical properties

Hydrogen bond acceptors 6
Hydrogen bond donors 3
Rotatable bonds 24
Molecular weight (Da) 619.4

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
LPA3 LPAR3 Human Lysophospholipid (LPA) A pKi 6.76 6.76 6.76 ChEMBL
LPA1 LPAR1 Human Lysophospholipid (LPA) A pKi 7.75 7.75 7.75 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
LPA3 LPAR3 Human Lysophospholipid (LPA) A pIC50 6.76 6.76 6.76 ChEMBL
LPA1 LPAR1 Human Lysophospholipid (LPA) A pIC50 6.96 6.96 6.96 ChEMBL