General
Preferred name
AMITHIOZONE
Synonyms
Diazam ()
Neotibil ()
Neustab ()
thioacetazone ()
Thiacetazone ()
Citazone ()
Thibone ()
TB I-698 ()
Thioacetazonum ()
Thiocarbazil ()
SQ-2321 ()
NSC-3550 ()
Thioparamizone ()
P&D ID
PD058430
CAS
104-06-3
Tags
drug candidate
natural product
available
Drug Status
investigational
Max Phase
Phase 2
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
5
ChEMBL Drugs
DrugBank
MedChem Express Bioactive Compound Library
ReFrame library
TargetMol Bioactive Compound Library
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
23
Properties
(calculated by RDKit )
Molecular Weight
236.07
Hydrogen Bond Acceptors
3
Hydrogen Bond Donors
4
Rotatable Bonds
3
Ring Count
1
Aromatic Ring Count
1
cLogP
2.08
TPSA
80.83
Fraction CSP3
0.1
Chiral centers
0.0
Largest ring
6.0
QED
0.28
Structural alerts
2
aggregator (Aggregator Advisor)
Aggregators
aggregator (ZINC)
Aggregators
Related compounds
Custom attributes
(extracted from source data)
Pathway
Anti-infection
Target
antibiotic
Bacterial
Source data
