CHEMBL4871482


SMILES Cc1nc(N)sc1CCCN/C(N)=N/C(=O)NCC(C)c1ccc(C(C)C)cc1
InChIKey MLGLIGBDVREXSK-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 4
Hydrogen bond donors 4
Rotatable bonds 8
Molecular weight (Da) 416.2

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
H4 HRH4 Human Histamine A pKi 5.58 5.58 5.58 ChEMBL
H2 HRH2 Human Histamine A pKi 6.83 6.83 6.83 ChEMBL
H1 HRH1 Human Histamine A pKi 5.31 5.31 5.31 ChEMBL
H3 HRH3 Human Histamine A pKi 5.1 5.1 5.1 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
H2 HRH2 Human Histamine A pEC50 6.55 7.0 7.46 ChEMBL