General
Preferred name
BOVINOCIDIN
Synonyms
3-Nitropropionic Acid ()
¦Â-Nitropropionic acid ()
??-Nitropropionic acid ()
3-NP ()
3-NP acid ()
3-Nitropropanoic acid ()
β-Nitropropionic Acid, 3-NP ()
??Nitropropionic acid ()
??Nitropropionic Acid, 3-NP ()
3-nitropropionate ()
β-Nitropropionic acid ()
¦Â-Nitropropionic Acid, 3-NP ()
P&D ID
PD001234
CAS
504-88-1
Tags
drug candidate
natural product
available
Drug indication
Discovery agent
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)
DESCRIPTION
Mitochondrial inhibitor; excitotoxin shown to cause brain lesions similar to those of Huntington's disease
(LOPAC library)
DESCRIPTION
Hedgehog acyltransferase (Hhat) inhibitor; cell permeable
(Tocris Bioactive Compound Library)
[[ p.pathway_name ]]
[[ compound.targets[tid].gene_name ]]
Compound Sets
7
Cayman Chemical Bioactives
DrugMAP
LOPAC library
MedChem Express Bioactive Compound Library
Selleckchem Bioactive Compound Library
TargetMol Bioactive Compound Library
Tocris Bioactive Compound Library
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
38
Molecular Weight
119.02
Hydrogen Bond Acceptors
3
Hydrogen Bond Donors
1
Rotatable Bonds
3
Ring Count
0
Aromatic Ring Count
0
cLogP
-0.26
TPSA
80.44
Fraction CSP3
0.67
Chiral centers
0.0
Largest ring
0.0
QED
0.41
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Pathway
Metabolism
Anti-infection
Apoptosis
Target
Dehydrogenase
Bacterial
Primary Target
Oxidative Phosphorylation
MOA
Inhibitor
Source data
