CHEMBL5837041


SMILES Cc1cc(-c2ccc(-c3cnn(C)c3Nc3cncc(OC(C)C)n3)nc2)ccc1C1(C(=O)O)CC1
InChIKey KAPVSPYBFCBQPD-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 8
Hydrogen bond donors 2
Rotatable bonds 8
Molecular weight (Da) 484.2

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
LPA1 LPAR1 Human Lysophospholipid (LPA) A pKi 7.14 7.14 7.14 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
LPA3 LPAR3 Human Lysophospholipid (LPA) A pIC50 5.98 5.98 5.98 ChEMBL
LPA1 LPAR1 Human Lysophospholipid (LPA) A pIC50 7.57 7.57 7.57 ChEMBL