Structure

InChI Key ZIODNPFQZIHCOE-UHFFFAOYSA-N
Smiles Cc1ccccc1N1CCN(CCc2nnc3n2CCCC3)CC1.Cl
InChI
InChI=1S/C19H27N5.ClH/c1-16-6-2-3-7-17(16)23-14-12-22(13-15-23)11-9-19-21-20-18-8-4-5-10-24(18)19;/h2-3,6-7H,4-5,8-15H2,1H3;1H

Physicochemical Descriptors

Property Name Value
Molecular Formula C19H28ClN5
Molecular Weight 361.92
AlogP 2.29
Hydrogen Bond Acceptor 5.0
Number of Rotational Bond 4.0
Polar Surface Area 37.19
Molecular species NEUTRAL
Aromatic Rings 2.0
Heavy Atoms 24.0

Pharmacology

Mechanism of Action Action Reference
Alpha-1a adrenergic receptor antagonist ANTAGONIST PubMed

Target Conservation

Protein: Alpha-1a adrenergic receptor

Description: Alpha-1A adrenergic receptor

Organism : Homo sapiens

P35348 ENSG00000120907

Cross References

Resources Reference
ChEMBL CHEMBL1201044
FDA SRS DS9UJN1I0X
PubChem 6917787
SureChEMBL SCHEMBL667604