TP-680

Ligand id: 885

Name: TP-680

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 9
Hydrogen bond donors 3
Rotatable bonds 12
Topological polar surface area 143.93
Molecular weight 619.23
XLogP 7.89
No. Lipinski's rules broken 2

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
2-[(2R)-3-[4-[di(phenyl)methyl]piperazin-1-yl]-2-(1H-indole-2-carbonylamino)-3-oxopropyl]sulfanylpyridine-3-carboxylic acid
Synonyms
TP 680
Database Links
CAS Registry No. 176915-07-4 (source: Scifinder)
PubChem CID 9873836
Search Google for chemical match using the InChIKey JWXZKQOPZVEJHR-PMERELPUSA-N
Search Google for chemicals with the same backbone JWXZKQOPZVEJHR
Search UniChem for chemical match using the InChIKey JWXZKQOPZVEJHR-PMERELPUSA-N
Search UniChem for chemicals with the same backbone JWXZKQOPZVEJHR