Emeramide SodiumProduct ingredient for Emeramide

Name
Emeramide Sodium
Drug Entry
Emeramide

Emeramide has been used in trials studying the treatment of Mercury Poisoning.

Accession Number
DBSALT002152
Structure
Synonyms
Not Available
UNII
E08TDQ7NT5
CAS Number
439602-51-4
Weight
Average: 328.36
Monoisotopic: 328.02920861
Chemical Formula
C12H14N2Na2O2S2
InChI Key
MCCQWWFYPPJJJP-UHFFFAOYSA-L
InChI
InChI=1S/C12H16N2O2S2.2Na/c15-11(13-4-6-17)9-2-1-3-10(8-9)12(16)14-5-7-18;;/h1-3,8,17-18H,4-7H2,(H,13,15)(H,14,16);;/q;2*+1/p-2
IUPAC Name
disodium [2-({3-[(2-sulfanidylethyl)carbamoyl]phenyl}formamido)ethyl]sulfanide
SMILES
[Na+].[Na+].[S-]CCNC(=O)C1=CC(=CC=C1)C(=O)NCC[S-]
ChemSpider
19238559
Predicted Properties
PropertyValueSource
Water Solubility0.584 mg/mLALOGPS
logP1.08ALOGPS
logP0.93Chemaxon
logS-2.8ALOGPS
pKa (Strongest Acidic)9.77Chemaxon
pKa (Strongest Basic)-0.64Chemaxon
Physiological Charge0Chemaxon
Hydrogen Acceptor Count2Chemaxon
Hydrogen Donor Count2Chemaxon
Polar Surface Area58.2 Å2Chemaxon
Rotatable Bond Count6Chemaxon
Refractivity80.44 m3·mol-1Chemaxon
Polarizability30.13 Å3Chemaxon
Number of Rings1Chemaxon
Bioavailability1Chemaxon
Rule of FiveYesChemaxon
Ghose FilterYesChemaxon
Veber's RuleNoChemaxon
MDDR-like RuleNoChemaxon