ATF 936

Ligand id: 9475

Name: ATF 936

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 3
Hydrogen bond donors 1
Rotatable bonds 6
Topological polar surface area 41.57
Molecular weight 409.19
XLogP 8.56
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
1-(phenylmethyl)-4-(4-propan-2-ylphenyl)-6-prop-2-ynoxyquinazolin-2-one
Synonyms
ATF936 | compound 10a [PMID: 20158186]
Database Links
GtoPdb PubChem SID 329968415
PubChem CID 10158373
Search Google for chemical match using the InChIKey WXYYACUWOMKZQC-UHFFFAOYSA-N
Search Google for chemicals with the same backbone WXYYACUWOMKZQC
Search UniChem for chemical match using the InChIKey WXYYACUWOMKZQC-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone WXYYACUWOMKZQC
Comments
Calcium sensing receptor negative allosteric modulator