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ChEMBL Statistics
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Compound Report Card

Compound Name and Classification

Compound ID CHEMBL446143
CHEMBL446143
Compound Name ORNITHINE
ChEMBL Synonyms Ornithine
Max Phase 3
Trade Names
Molecular Formula C5H12N2O2

Additional synonyms for CHEMBL446143 found using NCI Chemical Identifier Resolver

Compound Representations

Molfile Download MolFile
Canonical SMILES NCCC[C@H](N)C(=O)O
Standard InChI InChI=1S/C5H12N2O2/c6-3-1-2-4(7)5(8)9/h4H,1-3,6-7H2,(H,8,9)/ ...
Download InChI
Standard InChI Key AHLPHDHHMVZTML-BYPYZUCNSA-N

Molecule Features

CHEMBL446143 compound icon
Drug Type:Synthetic Small Molecule Rule of Five:Y First In Class:N Chirality:Single Stereoisomer Prodrug:N Oral:Unclassified Parenteral:Unclassified Topical:Unclassified Black Box:Unclassified Availability Type:Unclassified

Clinical Data

Number of clinical trials registered at clinicaltrials.gov
Number of reviews at The Cochrane Collaboration
Number of entries at British National Formulary

Structural Alerts

There are 2 structural alerts for CHEMBL446143. To view alerts please click here.

Alternate Forms of Compound in ChEMBL


CHEMBL446143

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
132.2 132.0899 -3.7 4 89.33 NEUTRAL


HBA HBD #Ro5 Violations HBA (Lipinski) HBD (Lipinski) #Ro5 Violations (Lipinski)
4 3 0 4 5 0


ACD Acidic pKa ACD Basic pKa ACD LogP ACD LogD pH7.4 Aromatic Rings Heavy Atoms QED Weighted
8.04 6.13 2.66 2.55 0 9 0.37

Compound Cross References

ChemSpider ChemSpider:AHLPHDHHMVZTML-BYPYZUCNSA-N
Wikipedia Ornithine

UniChem Cross References

View the UniChem Connectivity matches for CHEMBL446143



ACToR 410523-46-5 25104-12-5
ChEBI 15729
DrugBank DB00129
eMolecules 884260
FDA SRS E524N2IXA3
Guide to Pharmacology 725
Human Metabolome Database HMDB00214
IBM Patent System 6CB0001E8A29097530DB5D3DFC45A18C
KEGG Ligand C00077
Mcule MCULE-3029872280
Nikkaji J9.177D
PDBe ORN
PubChem 6262 88747248
PubChem: Thomson Pharma 15119954
SureChEMBL SCHEMBL8579

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