Cridanimod sodiumProduct ingredient for Cridanimod

Name
Cridanimod sodium
Drug Entry
Cridanimod
Accession Number
DBSALT003451
Structure
Synonyms
Camedon sodium / Cridanimod Na
External IDs
XBIO-101
UNII
54W868ROLR
CAS Number
58880-43-6
Weight
Average: 275.239
Monoisotopic: 275.05583747
Chemical Formula
C15H10NNaO3
InChI Key
FQMLTEAEJZVTAJ-UHFFFAOYSA-M
InChI
InChI=1S/C15H11NO3.Na/c17-14(18)9-16-12-7-3-1-5-10(12)15(19)11-6-2-4-8-13(11)16;/h1-8H,9H2,(H,17,18);/q;+1/p-1
IUPAC Name
sodium 2-(9-oxo-9,10-dihydroacridin-10-yl)acetate
SMILES
[Na+].[O-]C(=O)CN1C2=CC=CC=C2C(=O)C2=CC=CC=C12
ChemSpider
133580
Predicted Properties
PropertyValueSource
logP2.6Chemaxon
pKa (Strongest Acidic)3.68Chemaxon
pKa (Strongest Basic)-3.2Chemaxon
Physiological Charge0Chemaxon
Hydrogen Acceptor Count4Chemaxon
Hydrogen Donor Count0Chemaxon
Polar Surface Area60.44 Å2Chemaxon
Rotatable Bond Count2Chemaxon
Refractivity80.88 m3·mol-1Chemaxon
Polarizability25.12 Å3Chemaxon
Number of Rings3Chemaxon
Bioavailability1Chemaxon
Rule of FiveYesChemaxon
Ghose FilterYesChemaxon
Veber's RuleNoChemaxon
MDDR-like RuleNoChemaxon