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ChEMBL Statistics
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Compound Report Card

Compound Name and Classification

Compound ID CHEMBL212301
CHEMBL212301
Compound Name
ChEMBL Synonyms D-Arginine
Max Phase 0
Trade Names
Molecular Formula C6H14N4O2

Additional synonyms for CHEMBL212301 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES N[C@H](CCCNC(=N)N)C(=O)O
Standard InChI InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,( ...
Download InChI
Standard InChI Key ODKSFYDXXFIFQN-SCSAIBSYSA-N

Sources

  • PubChem BioAssays
  • Scientific Literature

Alternate Forms of Compound in ChEMBL


CHEMBL212301

Compound Bioactivity Summary

Compound Assay Summary

Compound Target Summary

Calculated Compound Parent Properties

Mol. Weight Mol. Weight Monoisotopic ALogP #Rotatable Bonds Polar Surface Area Molecular Species
174.2 174.1117 -3.83 6 125.21 ZWITTERION


HBA HBD #Ro5 Violations HBA (Lipinski) HBD (Lipinski) #Ro5 Violations (Lipinski)
4 5 0 6 7 1


ACD Acidic pKa ACD Basic pKa ACD LogP ACD LogD pH7.4 Aromatic Rings Heavy Atoms QED Weighted
2.49 13.58 -1.65 -5.12 0 12 0.16

Structural Alerts

There are 7 structural alerts for CHEMBL212301. To view alerts please click here.

Compound Cross References

ChemSpider ChemSpider:ODKSFYDXXFIFQN-SCSAIBSYSA-N
PubChem SID: 26754410 SID: 26754411
Wikipedia Arginine

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL212301



ACToR 134309-35-6
Brenda 1255 1349
ChEBI 15816
DrugBank DB04027
eMolecules 478564
FDA SRS R54Z304Z7C
Guide to Pharmacology 4680
Human Metabolome Database HMDB03416
IBM Patent System EE425DE9650CD5CE18ED7B39D474E553
KEGG Ligand C00792
Metabolights MTBLC15816
MolPort MolPort-003-925-879
Nikkaji J9.186C
NMRShiftDB 20096827
PubChem 71070
PubChem: Thomson Pharma 14772630
SureChEMBL SCHEMBL29456
ZINC ZINC000001532749

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