CHEMBL211465


SMILES CCCCCCCCCCCCCCCC(=O)OCC1CCP(O)(=S)O1
InChIKey HGTUZBIEGDZLRZ-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 4
Hydrogen bond donors 1
Rotatable bonds 16
Molecular weight (Da) 406.2

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 5.94 5.94 5.94 ChEMBL
LPA1 LPAR1 Human Lysophospholipid (LPA) A pKi 6.5 6.5 6.5 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
LPA3 LPAR3 Human Lysophospholipid (LPA) A pIC50 5.63 5.63 5.63 ChEMBL
LPA1 LPAR1 Human Lysophospholipid (LPA) A pIC50 6.1 6.1 6.1 ChEMBL