CHEMBL104994


SMILES CC(=O)c1ccc(OCCCN2CC[C@H](NC(=O)[C@@H](N)CO)C2)cc1
InChIKey IBVAFMSEJOGFLC-RDJZCZTQSA-N

Chemical properties

Hydrogen bond acceptors 6
Hydrogen bond donors 3
Rotatable bonds 9
Molecular weight (Da) 349.2

Drug properties

Molecular type Small molecule
Endogenous/Surrogate Surrogate
Approved drug No

Database connections

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
H3 HRH3 Rat Histamine A pKi 6.82 6.82 6.82 ChEMBL
H2 HRH2 Human Histamine A pKi 4.66 4.66 4.66 ChEMBL
H1 HRH1 Human Histamine A pKi 4.37 4.37 4.37 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database