AZD7762

Ligand id: 7713

Name: AZD7762

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 6
Hydrogen bond donors 4
Rotatable bonds 6
Topological polar surface area 124.49
Molecular weight 362.12
XLogP 2.02
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
3-(carbamoylamino)-5-(3-fluorophenyl)-N-[(3S)-piperidin-3-yl]thiophene-2-carboxamide
Synonyms
AZD 7762 | AZD-7762
Comments
AZD7762 was developed as an inhibitor of the checkpoint kinases, Chk1 and Chk2 [1], and was investigated as a therapeutic for solid and haematological malignancies. This compound is now included in AstaZeneca's Open Innovation Pharmacology Toolbox.
Database Links
CAS Registry No. 860352-01-8
ChEMBL Ligand CHEMBL2041933
GtoPdb PubChem SID 223366046
PubChem CID 11152667
RCSB PDB Ligand YDJ
Search Google for chemical match using the InChIKey IAYGCINLNONXHY-LBPRGKRZSA-N
Search Google for chemicals with the same backbone IAYGCINLNONXHY
Search UniChem for chemical match using the InChIKey IAYGCINLNONXHY-LBPRGKRZSA-N
Search UniChem for chemicals with the same backbone IAYGCINLNONXHY
SynPHARM 80208 (in complex with checkpoint kinase 1)