Structure

InChI Key ZQDJSWUEGOYDGT-UHFFFAOYSA-N
Smiles CN(C)CCOC(c1ccccc1)c1ccc(Br)cc1.Cl
InChI
InChI=1S/C17H20BrNO.ClH/c1-19(2)12-13-20-17(14-6-4-3-5-7-14)15-8-10-16(18)11-9-15;/h3-11,17H,12-13H2,1-2H3;1H

Physicochemical Descriptors

Property Name Value
Molecular Formula C17H21BrClNO
Molecular Weight 370.72
AlogP 4.12
Hydrogen Bond Acceptor 2.0
Number of Rotational Bond 6.0
Polar Surface Area 12.47
Molecular species BASE
Aromatic Rings 2.0
Heavy Atoms 20.0

Pharmacology

Mechanism of Action Action Reference
Histamine H1 receptor antagonist ANTAGONIST PubMed PubMed

Target Conservation

Protein: Histamine H1 receptor

Description: Histamine H1 receptor

Organism : Homo sapiens

P35367 ENSG00000196639

Cross References

Resources Reference
CAS NUMBER 1808-12-4
ChEBI 59178
ChEMBL CHEMBL1200967
FDA SRS 202J683U97
PubChem 15736
SureChEMBL SCHEMBL141831