General
Preferred name
DIBUTYL SEBACATE
Synonyms
PX-404 ()
Decanedioic acid, dibutyl ester ()
NSC-3893 ()
FEMA NO. 2373 ()
P&D ID
PD124095
CAS
109-43-3
Tags
available
drug candidate
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()] ]]
Description
(extracted from source data)
PRICE
29
DESCRIPTION
Dibutyl sebacate (Dibutyl decanedioate) is an organic compound primarily used as a plasticizer in plastic production.
[[ p.pathway_name ]]
[[ compound.targets[tid].gene_name ]]
Compound Sets
2
ChEMBL Drugs
Selleckchem Bioactive Compound Library
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
21
Molecular Weight
314.25
Hydrogen Bond Acceptors
4
Hydrogen Bond Donors
0
Rotatable Bonds
15
Ring Count
0
Aromatic Ring Count
0
cLogP
4.79
TPSA
52.6
Fraction CSP3
0.89
Chiral centers
0.0
Largest ring
0.0
QED
0.32
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Source data
