Bendazac lysineProduct ingredient for Bendazac

Name
Bendazac lysine
Drug Entry
Bendazac

Bendazac is an oxyacetic acid 1,2. Despite possessing anti-inflammatory, anti-necrotic, choleretic, and anti-lipidemic characteristics, most research has revolved around studying and demonstrating the agent's principal action in inhibiting the denaturation of proteins - an effect that has primarily proven useful in managing and delaying the progression of ocular cataracts 1,1. Bendazac, however, has since been withdrawn or discontinued in various international regions due to its capability or risk for eliciting hepatotoxicity 4,5,6,10 in patients although a small handful of regions may continue to have the medication available for purchase and use either as a topical anti-inflammatory/analgesic cream or eye drop formulation.

Accession Number
DBSALT003088
Structure
Synonyms
Bendazac lysinate / Bendazac lysine salt
External IDs
AF 1934 / AF-1934
UNII
CL7T957EGC
CAS Number
81919-14-4
Weight
Average: 428.489
Monoisotopic: 428.205970018
Chemical Formula
C22H28N4O5
InChI Key
OCOCFNMFLNFNIA-ZSCHJXSPSA-N
InChI
InChI=1S/C16H14N2O3.C6H14N2O2/c19-15(20)11-21-16-13-8-4-5-9-14(13)18(17-16)10-12-6-2-1-3-7-12;7-4-2-1-3-5(8)6(9)10/h1-9H,10-11H2,(H,19,20);5H,1-4,7-8H2,(H,9,10)/t;5-/m.0/s1
IUPAC Name
(2S)-2,6-diaminohexanoic acid; 2-[(1-benzyl-1H-indazol-3-yl)oxy]acetic acid
SMILES
NCCCC[C@H](N)C(O)=O.OC(=O)COC1=NN(CC2=CC=CC=C2)C2=C1C=CC=C2
ChemSpider
19966376
ChEMBL
CHEMBL1089222
Predicted Properties
PropertyValueSource
Water Solubility0.103 mg/mLALOGPS
logP2.89ALOGPS
logP3.06Chemaxon
logS-3.4ALOGPS
pKa (Strongest Acidic)3.66Chemaxon
pKa (Strongest Basic)-0.055Chemaxon
Physiological Charge-1Chemaxon
Hydrogen Acceptor Count4Chemaxon
Hydrogen Donor Count1Chemaxon
Polar Surface Area64.35 Å2Chemaxon
Rotatable Bond Count10Chemaxon
Refractivity88.76 m3·mol-1Chemaxon
Polarizability29.09 Å3Chemaxon
Number of Rings3Chemaxon
Bioavailability1Chemaxon
Rule of FiveYesChemaxon
Ghose FilterYesChemaxon
Veber's RuleNoChemaxon
MDDR-like RuleYesChemaxon