Oglufanide disodiumProduct ingredient for Oglufanide

Name
Oglufanide disodium
Drug Entry
Oglufanide

Oglufanide is a synthetic dipeptide immunomodulator in development for the treatment of chronic hepatitis C viral infection. Oglufanide was originally developed to treat severe infectious disease in Russia (where it is a registered pharmaceutical), and was extensively studied in cancer clinical trials in the United States before being acquired by Implicit Bioscience in 2005. Oglufanide works as a regulator of the body's immune response, is being given by intranasal administration to patients with chronic hepatitis C viral infection.

Accession Number
DBSALT002546
Structure
Synonyms
Glufanide disodium
External IDs
IM-862 / IM862
UNII
Q60AU1LLNU
CAS Number
237068-57-4
Weight
Average: 377.308
Monoisotopic: 377.09635922
Chemical Formula
C16H17N3Na2O5
InChI Key
GDLPAGOVHZLZEK-JBUFHSOLSA-L
InChI
InChI=1S/C16H19N3O5.2Na/c17-11(5-6-14(20)21)15(22)19-13(16(23)24)7-9-8-18-12-4-2-1-3-10(9)12;;/h1-4,8,11,13,18H,5-7,17H2,(H,19,22)(H,20,21)(H,23,24);;/q;2*+1/p-2/t11-,13-;;/m0../s1
IUPAC Name
disodium (4S)-4-amino-4-{[(1S)-1-carboxy-2-(1H-indol-3-yl)ethyl]carbamoyl}butanoate
SMILES
[Na+].[Na+].N[C@@H](CCC([O-])=O)C(=O)N[C@@H](CC1=CNC2=CC=CC=C12)C([O-])=O
ChemSpider
139673
ChEMBL
CHEMBL2107123
Predicted Properties
PropertyValueSource
Water Solubility1.97 mg/mLALOGPS
logP1.04ALOGPS
logP-2.2Chemaxon
logS-2.3ALOGPS
pKa (Strongest Acidic)3.44Chemaxon
pKa (Strongest Basic)8.45Chemaxon
Physiological Charge-1Chemaxon
Hydrogen Acceptor Count6Chemaxon
Hydrogen Donor Count3Chemaxon
Polar Surface Area151.17 Å2Chemaxon
Rotatable Bond Count8Chemaxon
Refractivity105.96 m3·mol-1Chemaxon
Polarizability32.74 Å3Chemaxon
Number of Rings2Chemaxon
Bioavailability1Chemaxon
Rule of FiveYesChemaxon
Ghose FilterNoChemaxon
Veber's RuleNoChemaxon
MDDR-like RuleNoChemaxon