CHEMBL4876025


SMILES Cc1nc(N)sc1CCCN/C(N)=N/C(=O)NC(c1ccccc1)c1ccccc1
InChIKey BLWGMVWWARNRMV-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 4
Hydrogen bond donors 4
Rotatable bonds 7
Molecular weight (Da) 422.2

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
H4 HRH4 Human Histamine A pKi 5.2 5.2 5.2 ChEMBL
H2 HRH2 Human Histamine A pKi 7.36 7.36 7.36 ChEMBL
H1 HRH1 Human Histamine A pKi 4.8 4.8 4.8 ChEMBL
H3 HRH3 Human Histamine A pKi 5.04 5.04 5.04 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
H2 HRH2 Human Histamine A pEC50 6.48 6.48 6.48 ChEMBL