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ChEMBL Statistics
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Compound Report Card

Compound Name and Classification

Compound ID CHEMBL2104514
CHEMBL2104514
Compound Name ARGININE GLUTAMATE
ChEMBL Synonyms ARGININE GLUTAMATE | MODUMATE
Max Phase 3
Trade Names
Molecular Formula C11H23N5O6

Additional synonyms for CHEMBL2104514 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES N[C@@H](CCCNC(=N)N)C(=O)O.N[C@@H](CCC(=O)O)C(=O)O
Standard InChI InChI=1S/C6H14N4O2.C5H9NO4/c7-4(5(11)12)2-1-3-10-6(8)9;6-3(5 ...
Download InChI
Standard InChI Key RVEWUBJVAHOGKA-WOYAITHZSA-N

Sources

  • USP Dictionary of USAN and International Drug Names
  • WHO Anatomical Therapeutic Chemical Classification

Alternate Forms of Compound in ChEMBL


CHEMBL2104514

Molecule Features

CHEMBL2104514 compound icon
Drug Type:Synthetic Small Molecule Rule of Five:N First In Class:N Chirality:Single Stereoisomer Prodrug:N Oral:Unclassified Parenteral:Unclassified Topical:Unclassified Black Box:Unclassified Availability Type:Unclassified

Clinical Data

ClinicalTrials.gov ARGININE GLUTAMATE
The Cochrane Collaboration ARGININE GLUTAMATE

Calculated Compound Parent Properties

Mol. Weight Mol. Weight Monoisotopic ALogP #Rotatable Bonds Polar Surface Area Molecular Species
321.3 321.1648 - - - -


HBA HBD #Ro5 Violations HBA (Lipinski) HBD (Lipinski) #Ro5 Violations (Lipinski)
- - - - - -


ACD Acidic pKa ACD Basic pKa ACD LogP ACD LogD pH7.4 Aromatic Rings Heavy Atoms QED Weighted
- - - - - - -0

Structural Alerts

There are no structural alerts for CHEMBL2104514

Compound Cross References

ATC A - ALIMENTARY TRACT AND METABOLISM
A05 - BILE AND LIVER THERAPY
A05B - LIVER THERAPY, LIPOTROPICS
A05BA - Liver therapy
A05BA01 - arginine glutamate

ChemSpider ChemSpider:RVEWUBJVAHOGKA-WOYAITHZSA-N

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL2104514



ACToR 4795-57-7
ChEBI 31234
ChemicalBook CB8126078
DrugBank DB13207
eMolecules 3718009 26732477
EPA CompTox Dashboard DTXSID3030002
FDA SRS TU1X77K34Q
Mcule MCULE-3135352673
MolPort MolPort-001-794-557
PubChem 165268
PubChem: Thomson Pharma 15469992 85205081
SureChEMBL SCHEMBL424415

UniChem REST Service Call:
https://www.ebi.ac.uk/unichem/rest/verbose_inchikey/RVEWUBJVAHOGKA-WOYAITHZSA-N spacer
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