CHEMBL3718626


SMILES COc1cc(OCc2csc(C3(O)CCC(C(=O)N(C)CC#N)CC3)n2)c2cc(-c3cn4nc(OC)sc4n3)oc2c1
InChIKey SBAHBPUZCJUMPW-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 13
Hydrogen bond donors 1
Rotatable bonds 9
Molecular weight (Da) 608.2

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
PAR4 PAR4 Human Proteinase-activated A pEC50 9.17 9.17 9.17 ChEMBL
PAR4 PAR4 Human Proteinase-activated A pIC50 7.55 7.55 7.55 ChEMBL