General
Preferred name
Azotochelin
Synonyms
P&D ID
PD148584
CAS
23369-85-9
Tags
nuisance
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
1
Nuisance compounds in cellular assays
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
14
Properties
(calculated by RDKit )
Molecular Weight
418.14
Hydrogen Bond Acceptors
7
Hydrogen Bond Donors
7
Rotatable Bonds
9
Ring Count
2
Aromatic Ring Count
2
cLogP
1.29
TPSA
176.42
Fraction CSP3
0.25
Chiral centers
1.0
Largest ring
6.0
QED
0.24
Structural alerts
1
Chelation
Nuisance compounds
Related compounds
Custom attributes
(extracted from source data)
Source data
