K-Ras(G12C) inhibitor 6

Ligand id: 8021

Name: K-Ras(G12C) inhibitor 6

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 4
Hydrogen bond donors 1
Rotatable bonds 8
Topological polar surface area 58.64
Molecular weight 372.1
XLogP 2.72
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
N-{1-[2-(2,4-dichlorophenoxy)acetyl]piperidin-4-yl}butanamide
Database Links
PubChem CID 91623354
Search Google for chemical match using the InChIKey XXJPOZZXKREAIA-UHFFFAOYSA-N
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Search UniChem for chemical match using the InChIKey XXJPOZZXKREAIA-UHFFFAOYSA-N
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Comments
This compound is a selective allosteric inhibitor of oncogenic KRASG12C [1].