General
Preferred name
BAKUCHIOL
Synonyms
(S)-(+)-Bakuchiol ()
Drupanol ()
UP-256 ()
(S)-Bakuchiol ()
Sytenol a ()
UP 256 ()
P&D ID
PD012036
CAS
10309-37-2
Tags
available
drug candidate
Drug Status
investigational
Max Phase
1.0
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 ]]
Cell lines
4
Organisms
0
Compound Sets
6
Cayman Chemical Bioactives
ChEMBL Drugs
Drug Repurposing Hub
DrugBank
MedChem Express Bioactive Compound Library
ReFrame library
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
25
Properties
(calculated by RDKit )
Molecular Weight
256.18
Hydrogen Bond Acceptors
1
Hydrogen Bond Donors
1
Rotatable Bonds
6
Ring Count
1
Aromatic Ring Count
1
cLogP
5.34
TPSA
20.23
Fraction CSP3
0.33
Chiral centers
1.0
Largest ring
6.0
QED
0.68
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Target
HIF1A
Carboxylesterase
p38 MAPK
UGT
MOA
DNA polymerase inhibitor
Pathway
Autophagy
MAPK/ERK Pathway
Metabolic Enzyme/Protease
Source data
