(S)-3,4-DCPG

Ligand id: 1407

Name: (S)-3,4-DCPG

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 7
Hydrogen bond donors 4
Rotatable bonds 4
Topological polar surface area 137.92
Molecular weight 239.04
XLogP -2.5
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
4-[(1S)-1-amino-2-hydroxy-2-oxoethyl]phthalic acid
Synonyms
(S)-3,4-dicarboxylphenylglycine
Database Links
BindingDB Ligand 50138783
CAS Registry No. 201730-11-2 (source: Scifinder)
ChEMBL Ligand CHEMBL143210
GtoPdb PubChem SID 135650423
PubChem CID 16062593
Search Google for chemical match using the InChIKey IJVMOGKBEVRBPP-ZETCQYMHSA-N
Search Google for chemicals with the same backbone IJVMOGKBEVRBPP
Search UniChem for chemical match using the InChIKey IJVMOGKBEVRBPP-ZETCQYMHSA-N
Search UniChem for chemicals with the same backbone IJVMOGKBEVRBPP
Wikipedia DCPG