D-aspartic acid

Ligand id: 6511

Name: D-aspartic acid

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 5
Hydrogen bond donors 3
Rotatable bonds 3
Topological polar surface area 100.62
Molecular weight 133.04
XLogP -3.71
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
(2R)-2-aminobutanedioic acid
Synonyms
D-aspartate
Database Links
CAS Registry No. 1783-96-6 (source: Scifinder)
ChEBI CHEBI:17364
ChEMBL Ligand CHEMBL29757
GtoPdb PubChem SID 178103125
PubChem CID 83887
RCSB PDB Ligand DAS
Search Google for chemical match using the InChIKey CKLJMWTZIZZHCS-UWTATZPHSA-N
Search Google for chemicals with the same backbone CKLJMWTZIZZHCS
Search UniChem for chemical match using the InChIKey CKLJMWTZIZZHCS-UWTATZPHSA-N
Search UniChem for chemicals with the same backbone CKLJMWTZIZZHCS
Comments
This ligand entry also represents D-aspartate (CHEBI:29994), the carboxylate anion and salt form of the acid. It is in the aspartate form that the ligand is transported across cell membranes.