Ethacridine lactateProduct ingredient for Ethacridine

Name
Ethacridine lactate
Drug Entry
Ethacridine
Accession Number
DBSALT002482
Structure
Synonyms
6,9-diamino-2-ethoxyacridine lactate / Ethacridine lactate anhydrous
UNII
7T7T2I9823
CAS Number
1837-57-6
Weight
Average: 343.383
Monoisotopic: 343.153206168
Chemical Formula
C18H21N3O4
InChI Key
IYLLULUTZPKQBW-UHFFFAOYSA-N
InChI
InChI=1S/C15H15N3O.C3H6O3/c1-2-19-10-4-6-13-12(8-10)15(17)11-5-3-9(16)7-14(11)18-13;1-2(4)3(5)6/h3-8H,2,16H2,1H3,(H2,17,18);2,4H,1H3,(H,5,6)
IUPAC Name
2-hydroxypropanoic acid; 7-ethoxy-9-imino-9,10-dihydroacridin-3-amine
SMILES
CC(O)C(O)=O.CCOC1=CC2=C(NC3=C(C=CC(N)=C3)C2=N)C=C1
KEGG Compound
C12677
ChemSpider
15012
ChEBI
31172
ChEMBL
CHEMBL582355
Wikipedia
Ethacridine_lactate
Predicted Properties
PropertyValueSource
Water Solubility0.192 mg/mLALOGPS
logP2.59ALOGPS
logP2.28Chemaxon
logS-3.1ALOGPS
pKa (Strongest Acidic)18.09Chemaxon
pKa (Strongest Basic)12.12Chemaxon
Physiological Charge1Chemaxon
Hydrogen Acceptor Count4Chemaxon
Hydrogen Donor Count3Chemaxon
Polar Surface Area71.13 Å2Chemaxon
Rotatable Bond Count3Chemaxon
Refractivity87.45 m3·mol-1Chemaxon
Polarizability28.25 Å3Chemaxon
Number of Rings3Chemaxon
Bioavailability1Chemaxon
Rule of FiveYesChemaxon
Ghose FilterYesChemaxon
Veber's RuleNoChemaxon
MDDR-like RuleNoChemaxon