CHEMBL1622468


SMILES COC(=O)c1ccc2c(c1)C(C)(C)C(/C=C/c1ccccc1O)=[N+]2C
InChIKey CRZMPBDMWJWPBA-UHFFFAOYSA-O

Chemical properties

Hydrogen bond acceptors 3
Hydrogen bond donors 1
Rotatable bonds 3
Molecular weight (Da) 336.2

Drug properties

Molecular type Small molecule
Physiological/Surrogate Surrogate
Approved drug No

Database connections

Sankey plot

Compound is not listed as a drug.

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
S1P4 S1PR4 Human Lysophospholipid (S1P) A pIC50 6.1 6.1 6.1 ChEMBL
NTS1 NTR1 Human Neurotensin A pEC50 4.74 4.74 4.74 ChEMBL
GPR55 GPR55 Human GPR18, GPR55 and GPR119 A pEC50 5.56 5.56 5.56 ChEMBL
S1P1 S1PR1 Human Lysophospholipid (S1P) A pIC50 5.32 5.32 5.32 ChEMBL