CHEMBL3805220


SMILES N#C/N=C(/NCCSc1ccccc1)NC[C@@H]1CC[C@@H](c2c[nH]cn2)C1
InChIKey MMZLYDNVAYWZLR-HZPDHXFCSA-N

Chemical properties

Hydrogen bond acceptors 4
Hydrogen bond donors 3
Rotatable bonds 7
Molecular weight (Da) 368.2

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 5.98 5.98 5.98 ChEMBL
H2 HRH2 Human Histamine A pKi 5.01 5.01 5.01 ChEMBL
H1 HRH1 Human Histamine A pKi 5.1 5.1 5.1 ChEMBL
H3 HRH3 Human Histamine A pKi 6.23 6.23 6.23 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
H4 HRH4 Mouse Histamine A pEC50 6.23 6.23 6.23 ChEMBL
H4 HRH4 Human Histamine A pEC50 6.3 6.3 6.3 ChEMBL