D-ornithine   

GtoPdb Ligand ID: 4682

2D Structure
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Physico-chemical Properties
Hydrogen bond acceptors 4
Hydrogen bond donors 3
Rotatable bonds 4
Topological polar surface area 89.34
Molecular weight 132.09
XLogP -3.31
No. Lipinski's rules broken 0
SMILES / InChI / InChIKey
Canonical SMILES NC(C(=O)O)CCCN
Isomeric SMILES N[C@@H](C(=O)O)CCCN
InChI InChI=1S/C5H12N2O2/c6-3-1-2-4(7)5(8)9/h4H,1-3,6-7H2,(H,8,9)/t4-/m1/s1
InChI Key AHLPHDHHMVZTML-SCSAIBSYSA-N
Classification
Compound class Metabolite or derivative
IUPAC Name
(2R)-2,5-diaminopentanoic acid
Database Links
CAS Registry No. 348-66-3 (source: Scifinder)
ChEBI CHEBI:16176
ChEMBL Ligand CHEMBL103686
GtoPdb PubChem SID 178101396
PubChem CID 71082
RCSB PDB Ligand ORD
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