EPINASTINE HYDROCHLORIDE

Search structure
Trade Names:
Synonyms:
Status: Approved (2003)
Entry Type: Small molecule
Molecule Category: Salt
UNII: GFM415S5XL
Parent Compound: EPINASTINE

Structure
InChI Key VKXSGUIOOQPGAF-UHFFFAOYSA-N
Smile Cl.NC1=NCC2c3ccccc3Cc3ccccc3N12
InChI
InChI=1S/C16H15N3.ClH/c17-16-18-10-15-13-7-3-1-5-11(13)9-12-6-2-4-8-14(12)19(15)16;/h1-8,15H,9-10H2,(H2,17,18);1H

Physicochemical Descriptors

Property Name Value
Molecular Formula C16H16ClN3
Molecular Weight 285.78
AlogP 2.47
Hydrogen Bond Acceptor 3.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 0.0
Polar Surface Area 41.62
Molecular species BASE
Aromatic Rings 2.0
Heavy Atoms 19.0

Pharmacology

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

Indications

Mesh Heading Maximum Phase Mesh ID Reference

Related Entries

Scaffolds

Parent

Adverse Reactions

SOC By Demographic Distribution
System Organ Classification (SOC)
Relative Frequency (%)
Nervous system disorders
17.07
Eye disorders
12.2
Investigations
12.2
General disorders and administration site conditions
9.76
Injury, poisoning and procedural complications
9.76
Skin and subcutaneous tissue disorders
7.32
Vascular disorders
7.32
Gastrointestinal disorders
4.88
Musculoskeletal and connective tissue disorders
4.88
Respiratory, thoracic and mediastinal disorders
4.88
Immune system disorders
2.44
Infections and infestations
2.44
Metabolism and nutrition disorders
2.44
Renal and urinary disorders
2.44

Cross References

Resources Reference
ChEBI 51037
ChEMBL CHEMBL1200491
EPA CompTox DTXSID1046502
FDA SRS GFM415S5XL
Guide to Pharmacology 7176
KEGG D07900
PubChem 157313
SureChEMBL SCHEMBL122749
ZINC ZINC01999487
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