General
Preferred name
DIFEBARBAMATE
Synonyms
Difebarbamato ()
P&D ID
PD072144
CAS
15687-09-9
Tags
available
drug
Drug Status
approved
investigational
Max Phase
2.0
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
4
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
13
Properties
(calculated by RDKit )
Molecular Weight
578.3
Hydrogen Bond Acceptors
9
Hydrogen Bond Donors
2
Rotatable Bonds
18
Ring Count
2
Aromatic Ring Count
1
cLogP
2.69
TPSA
180.79
Fraction CSP3
0.61
Chiral centers
2.0
Largest ring
6.0
QED
0.2
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Source data
