pentylthio-TZTP

Ligand id: 304

Name: pentylthio-TZTP

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 3
Hydrogen bond donors 0
Rotatable bonds 6
Topological polar surface area 82.56
Molecular weight 283.12
XLogP 3.03
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
1-methyl-3-(4-pentylsulfanyl-1,2,5-thiadiazol-3-yl)-5,6-dihydro-2H-pyridine
Database Links
BindingDB Ligand 50003363
ChEMBL Ligand CHEMBL130715
PubChem CID 10062394
Search Google for chemical match using the InChIKey LRTWCQHCJKYNPS-UHFFFAOYSA-N
Search Google for chemicals with the same backbone LRTWCQHCJKYNPS
Search UniChem for chemical match using the InChIKey LRTWCQHCJKYNPS-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone LRTWCQHCJKYNPS