D-arginine   

GtoPdb Ligand ID: 4680

2D Structure
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Physico-chemical Properties
Hydrogen bond acceptors 6
Hydrogen bond donors 4
Rotatable bonds 5
Topological polar surface area 127.72
Molecular weight 174.11
XLogP -3.58
No. Lipinski's rules broken 0
SMILES / InChI / InChIKey
Canonical SMILES OC(=O)C(CCCN=C(N)N)N
Isomeric SMILES OC(=O)[C@@H](CCCN=C(N)N)N
InChI InChI=1S/C6H14N4O2/c7-4(5(11)12)2-1-3-10-6(8)9/h4H,1-3,7H2,(H,11,12)(H4,8,9,10)/t4-/m1/s1
InChI Key ODKSFYDXXFIFQN-SCSAIBSYSA-N
Classification
Compound class Metabolite or derivative
IUPAC Name
(2R)-2-amino-5-[(diaminomethylidene)amino]pentanoic acid
Database Links
CAS Registry No. 157-06-2 (source: Scifinder)
ChEBI CHEBI:15816
ChEMBL Ligand CHEMBL212301
GtoPdb PubChem SID 178101394
PubChem CID 71070
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