CHEMBL212029


SMILES CCCCCCCCCCCCCCCCCC(=O)OCC1CCP(O)(=S)O1
InChIKey YZILIQNNTIKUCA-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 4
Hydrogen bond donors 1
Rotatable bonds 18
Molecular weight (Da) 434.3

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
LPA3 LPAR3 Human Lysophospholipid (LPA) A pKi 6.2 6.2 6.2 ChEMBL
LPA1 LPAR1 Human Lysophospholipid (LPA) A pKi 6.39 6.39 6.39 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
LPA3 LPAR3 Human Lysophospholipid (LPA) A pIC50 5.9 5.9 5.9 ChEMBL
LPA1 LPAR1 Human Lysophospholipid (LPA) A pIC50 6.03 6.03 6.03 ChEMBL