General
Preferred name
decamethoxine
Synonyms
Septefril ()
Decametoxin ()
P&D ID
PD073716
CAS
11103-59-6
38146-42-8
Tags
available
drug candidate
drug
Drug Status
approved
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
DrugCentral
DrugCentral Approved Drugs
MedChem Express Bioactive Compound Library
ReFrame library
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
14
Properties
(calculated by RDKit )
Molecular Weight
622.56
Hydrogen Bond Acceptors
4
Hydrogen Bond Donors
0
Rotatable Bonds
19
Ring Count
2
Aromatic Ring Count
0
cLogP
8.27
TPSA
52.6
Fraction CSP3
0.95
Chiral centers
6.0
Largest ring
6.0
QED
0.08
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Pathway
Anti-infection
Target
Bacterial
Fungal
Source data
