NKY80

Ligand id: 5233

Name: NKY80

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 4
Hydrogen bond donors 1
Rotatable bonds 1
Topological polar surface area 82.01
Molecular weight 229.09
XLogP 0.6
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
2-amino-7-(furan-2-yl)-5,6,7,8-tetrahydroquinazolin-5-one
Synonyms
adenylyl cyclase type V Inhibitor | NKY 80 | NKY-80
Database Links
CAS Registry No. 299442-43-6
ChEMBL Ligand CHEMBL1456284
PubChem CID 2772368
Search Google for chemical match using the InChIKey SOJUSNIBPPMLCC-UHFFFAOYSA-N
Search Google for chemicals with the same backbone SOJUSNIBPPMLCC
Search UniChem for chemical match using the InChIKey SOJUSNIBPPMLCC-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone SOJUSNIBPPMLCC
Comments
NKY80 is an adenine-like small molecule which acts as an adenylyl cyclase inhibitor, exhibiting modest selectivity for AC5/6 over other adenylyl cyclase isoforms [1].