CHEMBL316968


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

Chemical properties

Hydrogen bond acceptors 7
Hydrogen bond donors 3
Rotatable bonds 10
Molecular weight (Da) 449.3

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 6.23 6.23 6.23 ChEMBL
H2 HRH2 Human Histamine A pKi 4.34 4.34 4.34 ChEMBL
H1 HRH1 Human Histamine A pKi 4.12 4.12 4.12 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database