General
Preferred name
Dichlorophenyl-ABA
Synonyms
P&D ID
PD126205
CAS
18201-65-5
Tags
available
Structure
Probe scores
P&D probe-likeness score
[[ v.score ]]%
Structure formats
[[ format ]]
[[ compound[format === 'MOL' ? 'molblock' : format.toLowerCase()] ]]
Description
(extracted from source data)
DESCRIPTION Dichlorophenyl-ABA is an inhibitor of transthyretin (TTR) amyloid fibril formation, inhibiting aggregate formation in more than 80% in TTR L55P-expressing cells[1].
Compound Sets
1
MedChem Express Bioactive Compound Library
External IDs
14
Properties
(calculated by RDKit )
Molecular Weight
281.0
Hydrogen Bond Acceptors
2
Hydrogen Bond Donors
2
Rotatable Bonds
3
Ring Count
2
Aromatic Ring Count
2
cLogP
4.44
TPSA
49.33
Fraction CSP3
0.0
Chiral centers
0.0
Largest ring
6.0
QED
0.87
Structural alerts
0
No structural alerts detected
Custom attributes
(extracted from source data)
Target
Transthyretin (TTR)
Pathway
Neuronal Signaling
Source data