BENOXINATE HYDROCHLORIDE

Search structure
Trade Names:
Synonyms:
Status: Approved (1982)
Entry Type: Small molecule
Molecule Category: Salt
UNII: 0VE4U49K15

Structure
InChI Key PRGUDWLMFLCODA-UHFFFAOYSA-N
Smile CCCCOc1cc(C(=O)OCCN(CC)CC)ccc1N.Cl
InChI
InChI=1S/C17H28N2O3.ClH/c1-4-7-11-21-16-13-14(8-9-15(16)18)17(20)22-12-10-19(5-2)6-3;/h8-9,13H,4-7,10-12,18H2,1-3H3;1H

Physicochemical Descriptors

Property Name Value
Molecular Formula C17H29ClN2O3
Molecular Weight 344.88
AlogP 2.95
Hydrogen Bond Acceptor 5.0
Hydrogen Bond Donor 1.0
Number of Rotational Bond 10.0
Polar Surface Area 64.79
Molecular species BASE
Aromatic Rings 1.0
Heavy Atoms 22.0

Pharmacology

Action Mechanism of Action Reference
BLOCKER Sodium channel alpha subunit blocker PubMed Wikipedia

Related Entries

Mixture

Cross References

Resources Reference
ChEBI 31260
ChEMBL CHEMBL1200654
EPA CompTox DTXSID4045393
FDA SRS 0VE4U49K15
PubChem 22304
SureChEMBL SCHEMBL212440
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