Ligand id: 10384

Name: NUDT7-COV-1

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 4
Hydrogen bond donors 1
Rotatable bonds 7
Topological polar surface area 49.41
Molecular weight 390.09
XLogP 3.81
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

1. Resnick E, Bradley A, Gan J, Douangamath A, Krojer T, Sethi R, Aimon A, Amitai G, Belini D, Bennett J, Fairhead M et al.. (2018)
Rapid covalent-probe discovery by electrophile fragment screening.
bioRxiv,. DOI: 10.1101/442806