General
Preferred name
PROPICONAZOLE
Synonyms
Propiconazole-d3 (nitrate) ()
Propiconazole-d7 ()
P&D ID
PD080615
CAS
60207-90-1
2699607-26-4
1246818-14-3
Tags
available
Probe control
Probe control not defined
Orthogonal probes
0
No orthogonal probes found
Similar probes
0
No structurally similar probes found
Structure
P&D probe-likeness score
Structure formats
[[ format ]]
[[ compound[format === 'MOL' ? 'molblock' : format.toLowerCase()] ]]
[[ p.pathway_name ]]
[[ compound.targets[tid].gene_name ]]
Cell lines
0
Organisms
1
Compound Sets
2
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
29
Properties
(calculated by RDKit )
Molecular Weight
341.07
Hydrogen Bond Acceptors
5
Hydrogen Bond Donors
0
Rotatable Bonds
5
Ring Count
3
Aromatic Ring Count
2
cLogP
3.65
TPSA
49.17
Fraction CSP3
0.47
Chiral centers
2.0
Largest ring
6.0
QED
0.83
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Pathway
Anti-infection
Immunology/Inflammation
Metabolic Enzyme/Protease
NF-κB
Target
Fungal
Reactive Oxygen Species
Source data
