CHEMBL489493


SMILES CC(C)(C)CC(=O)c1cccc(Cc2c[nH]cn2)c1
InChIKey SHQNNJIERWMYHK-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 2
Hydrogen bond donors 1
Rotatable bonds 4
Molecular weight (Da) 256.2

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
H3 HRH3 Guinea pig Histamine A pKd 6.02 6.02 6.02 ChEMBL
H4 HRH4 Human Histamine A pKi 8.25 8.25 8.25 ChEMBL
H3 HRH3 Human Histamine A pKi 7.49 7.49 7.49 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
H3 HRH3 Human Histamine A pEC50 7.1 7.1 7.1 ChEMBL