NS11757

Ligand id: 2944

Name: NS11757

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 3
Hydrogen bond donors 2
Rotatable bonds 2
Topological polar surface area 40.71
Molecular weight 331.06
XLogP 4.82
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
N-(6,7-dichloro-1,2,3,4-tetrahydronaphthalen-1-yl)-1H-1,3-benzodiazol-2-amine
Synonyms
compound 39 [PMID: 18998663] [1] | NS-11757
Comments
The reference cited for this compound specifies that it is racemic.
Database Links
ChEMBL Ligand CHEMBL511710
GtoPdb PubChem SID 135650742
PubChem CID 25102784
Search Google for chemical match using the InChIKey JHLGZRSIUIFADK-UHFFFAOYSA-N
Search Google for chemicals with the same backbone JHLGZRSIUIFADK
Search UniChem for chemical match using the InChIKey JHLGZRSIUIFADK-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone JHLGZRSIUIFADK