General
Preferred name
TOLTRAZURIL
Synonyms
BAY-i 9142 ()
Baycox ()
Toltrazurilo ()
Toltrazurilum ()
BAY VI 9142 ()
NSC-759176 ()
BAY-VI-9142 ()
P&D ID
PD000337
CAS
69004-03-1
Tags
drug candidate
natural product
available
Drug indication
Coccidiostat (veterinary)
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 ]]
Compound Sets
8
Cayman Chemical Bioactives
ChEMBL Drugs
Drug Repurposing Hub
MedChem Express Bioactive Compound Library
Prestwick Chemical Library
Selleckchem Bioactive Compound Library
TargetMol Bioactive Compound Library
The Spectrum Collection
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
23
Properties
(calculated by RDKit )
Molecular Weight
425.07
Hydrogen Bond Acceptors
7
Hydrogen Bond Donors
1
Rotatable Bonds
4
Ring Count
3
Aromatic Ring Count
3
cLogP
2.94
TPSA
86.09
Fraction CSP3
0.17
Chiral centers
0.0
Largest ring
6.0
QED
0.65
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Pathway
Microbiology&virology
Anti-infection
Target
antibiotic
Parasite
MOA
Antibiotic
antiprotozoal agent
Indication
coccidiosis
Source data
