General
Preferred name
NEQUINATE
Synonyms
ICI-55052 ()
Methyl Benzoquate ()
AY-20385 ()
Neoquate ()
ICI 55,052 ()
Nequinato ()
AY-20,385 ()
P&D ID
PD014767
CAS
13997-19-8
Tags
available
drug
Drug Status
vet_approved
approved
investigational
Max Phase
2.0
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()] ]]
Description
(extracted from source data)
PRICE
48
DESCRIPTION
Nequinate is an anticoccidial agent, preventing coccidiosis .
(TargetMol Bioactive Compound Library)
[[ p.pathway_name ]]
[[ compound.targets[tid].gene_name ]]
Compound Sets
6
ChEMBL Drugs
DrugBank
DrugBank Approved Drugs
NPC Screening Collection
ReFrame library
TargetMol Bioactive Compound Library
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
23
Molecular Weight
365.16
Hydrogen Bond Acceptors
4
Hydrogen Bond Donors
1
Rotatable Bonds
7
Ring Count
3
Aromatic Ring Count
3
cLogP
4.24
TPSA
68.39
Fraction CSP3
0.27
Chiral centers
0.0
Largest ring
6.0
QED
0.64
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Target
Parasite
Xanthine oxidase
Pathway
Metabolism
Microbiology/virology
Source data
