General
Preferred name
QUINOXYFEN
Synonyms
DE-795 ()
P&D ID
PD119070
CAS
124495-18-7
Tags
available
Structure
Probe scores
P&D probe-likeness score
[[ v.score ]]%
Structure formats
[[ format ]]
[[ compound[format === 'MOL' ? 'molblock' : format.toLowerCase()] ]]
Compound Sets
2
MedChem Express Bioactive Compound Library
The Spectrum Collection
External IDs
19
Properties
(calculated by RDKit )
Molecular Weight
307.0
Hydrogen Bond Acceptors
2
Hydrogen Bond Donors
0
Rotatable Bonds
2
Ring Count
3
Aromatic Ring Count
3
cLogP
5.47
TPSA
22.12
Fraction CSP3
0.0
Chiral centers
0.0
Largest ring
6.0
QED
0.63
Structural alerts
0
No structural alerts detected
Custom attributes
(extracted from source data)
Pathway
Anti-infection
Target
Fungal
Source data