Structure

InChI Key WYUYEJNGHIOFOC-NWBUNABESA-N
Smile Cc1ccc(/C(=C\CN2CCCC2)c2ccccn2)cc1.Cl
InChI
InChI=1S/C19H22N2.ClH/c1-16-7-9-17(10-8-16)18(19-6-2-3-12-20-19)11-15-21-13-4-5-14-21;/h2-3,6-12H,4-5,13-15H2,1H3;1H/b18-11+;

Physicochemical Descriptors

Property Name Value
Molecular Formula C19H25ClN2O
Molecular Weight 332.88
AlogP 3.92
Hydrogen Bond Acceptor 2.0
Hydrogen Bond Donor 0.0
Number of Rotational Bond 4.0
Polar Surface Area 16.13
Molecular species BASE
Aromatic Rings 2.0
Heavy Atoms 21.0

Pharmacology

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

Indications

Mesh Heading Maximum Phase Mesh ID Reference

Related Entries

Scaffolds

Mixture
Mixture

Cross References

Resources Reference
ChEBI 32265
ChEMBL CHEMBL3188034
EPA CompTox DTXSID0021410
FDA SRS YAN7R5L890
PubChem 5282442
SureChEMBL SCHEMBL1140974