General
Preferred name
Bisphenol A diglycidyl ether
Synonyms
BADGE ()
P&D ID
PD020695
CAS
500008-19-5
116161-20-7
1675-54-3
Tags
available
drug
Drug indication
Discovery agent
Drug Status
experimental
approved
Probe control
Probe control not defined
Orthogonal probes
0
No orthogonal probes found
Similar probes
0
No structurally similar probes found
Structure formats
[[ format ]]
[[ compound[format === 'MOL' ? 'molblock' : format.toLowerCase()] ]]
Description
(extracted from source data)
DESCRIPTION
PPARĪ³ antagonist
(Tocriscreen Total)
[[ p.pathway_name ]]
[[ compound.targets[tid].gene_name ]]
Cell lines
1
Organisms
0
Compound Sets
7
Cayman Chemical Bioactives
CZ-OPENSCREEN Bioactive Library
DrugBank
DrugBank Approved Drugs
DrugMAP
NCATS Inxight Approved Drugs
Tocriscreen Total
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
28
Properties
(calculated by RDKit )
Molecular Weight
340.17
Hydrogen Bond Acceptors
4
Hydrogen Bond Donors
0
Rotatable Bonds
8
Ring Count
4
Aromatic Ring Count
2
cLogP
3.57
TPSA
43.52
Fraction CSP3
0.43
Chiral centers
2.0
Largest ring
6.0
QED
0.69
Structural alerts
0
No structural alerts detected
Custom attributes
(extracted from source data)
Source data