Ki16425

Chemical Properties

SMILES OC(=O)CCSCc1ccc(cc1)c1onc(c1NC(=O)OC(c1ccccc1Cl)C)C
Hydrogen bond acceptors 6
Hydrogen bond donors 2
Rotatable bonds 9
Molecular weight 474.1

Drug Properties

Type Small molecule
Endogenous No
Approved No
InChIKey LLIFMNUXGDHTRO-UHFFFAOYSA-N

Database Connections

External Links


Bioactivity

Receptor Experimental Data Source
GTP Uniprot Species Family Class Type Min Avg Max Database
GPR87 GPR87 Human A orphans A - - - - Guide to Pharmacology
LPA1 LPAR1 Mouse Lysophospholipid (LPA) A pIC50 6.6 6.75 6.9 Guide to Pharmacology
LPA2 LPAR2 Human Lysophospholipid (LPA) A pKi 5.25 5.25 5.25 Guide to Pharmacology
LPA3 LPAR3 Human Lysophospholipid (LPA) A pKi 6.44 6.44 6.44 Guide to Pharmacology
LPA1 LPAR1 Rat Lysophospholipid (LPA) A pIC50 6.8 6.8 6.8 ChEMBL
LPA3 LPAR3 Human Lysophospholipid (LPA) A pIC50 6.52 6.52 6.52 ChEMBL
LPA3 LPAR3 Human Lysophospholipid (LPA) A pKi 6.83 6.83 6.83 ChEMBL
LPA1 LPAR1 Human Lysophospholipid (LPA) A pIC50 6.12 6.64 7.34 ChEMBL
LPA1 LPAR1 Human Lysophospholipid (LPA) A pKi 6.37 6.37 6.37 ChEMBL