General
Preferred name
PENTHIOPYRAD
Synonyms
MTF-753 ()
P&D ID
PD063749
CAS
183675-82-3
Tags
available
Structure
Probe scores
P&D probe-likeness score
[[ v.score ]]%
Structure formats
[[ format ]]
[[ compound[format === 'MOL' ? 'molblock' : format.toLowerCase()] ]]
Description
(extracted from source data)
DESCRIPTION Penthiopyrad is a novel fungicide used in the protection of crops. (BOC Sciences Bioactive Compounds)
Compound Sets
3
BOC Sciences Bioactive Compounds
EU-OPENSCREEN Bioactive Compound Library
MedChem Express Bioactive Compound Library
External IDs
17
Properties
(calculated by RDKit )
Molecular Weight
359.13
Hydrogen Bond Acceptors
4
Hydrogen Bond Donors
1
Rotatable Bonds
5
Ring Count
2
Aromatic Ring Count
2
cLogP
4.9
TPSA
46.92
Fraction CSP3
0.5
Chiral centers
1.0
Largest ring
5.0
QED
0.83
Structural alerts
0
No structural alerts detected
Custom attributes
(extracted from source data)
Pathway
Anti-infection
Target
Fungal
Source data