CL316243

Ligand id: 3462

Name: CL316243

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 6
Hydrogen bond donors 4
Rotatable bonds 8
Topological polar surface area 125.32
Molecular weight 421.09
XLogP 2.38
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
5-[(2R)-2-[[(2R)-2-(3-chlorophenyl)-2-hydroxyethyl]amino]propyl]-1,3-benzodioxole-2,2-dicarboxylic acid
Synonyms
CL-316243 | CL316,243
Database Links
CAS Registry No. 183720-02-7 (source: Scifinder)
ChEMBL Ligand CHEMBL1204876
PubChem CID 5486546
Search Google for chemical match using the InChIKey JEDJMKTVUPSHFW-ABAIWWIYSA-N
Search Google for chemicals with the same backbone JEDJMKTVUPSHFW
Search UniChem for chemical match using the InChIKey JEDJMKTVUPSHFW-ABAIWWIYSA-N
Search UniChem for chemicals with the same backbone JEDJMKTVUPSHFW