Structure

InChI Key ZOMBFZRWMLIDPX-UHFFFAOYSA-N
Smiles CCN1CC(CCN2CCOCC2)C(c2ccccc2)(c2ccccc2)C1=O.Cl.O
InChI
InChI=1S/C24H30N2O2.ClH.H2O/c1-2-26-19-22(13-14-25-15-17-28-18-16-25)24(23(26)27,20-9-5-3-6-10-20)21-11-7-4-8-12-21;;/h3-12,22H,2,13-19H2,1H3;1H;1H2

Physicochemical Descriptors

Property Name Value
Molecular Formula C24H33ClN2O3
Molecular Weight 432.99
AlogP 3.17
Hydrogen Bond Acceptor 3.0
Number of Rotational Bond 6.0
Polar Surface Area 32.78
Molecular species NEUTRAL
Aromatic Rings 2.0
Heavy Atoms 28.0

Pharmacology

Mechanism of Action Action Reference
Potassium channel subfamily K member 3 blocker BLOCKER PubMed FDA

Target Conservation

Protein: Potassium channel subfamily K member 3

Description: Potassium channel subfamily K member 3

Organism : Homo sapiens

O14649 ENSG00000171303
Protein: Potassium channel subfamily K member 9

Description: Potassium channel subfamily K member 9

Organism : Homo sapiens

Q9NPC2 ENSG00000169427

Cross References

Resources Reference
ChEBI 31520
ChEMBL CHEMBL3989519
FDA SRS P5RU6UOQ5Y
PubChem 64648
SureChEMBL SCHEMBL40643