General
Preferred name
BORNYL ACETATE
Synonyms
Isobornyl acetate ()
Bornyl acetic ether ()
2-Camphanol acetate ()
(-)-Bornyl acetate ()
L-(-)-Bornyl acetate ()
Isobornyl acetate, Bornyl acetic ether, 2-Camphanol acetate ()
(±)-Bornyl Acetate ()
P&D ID
PD088268
CAS
76-49-3
5655-61-8
Tags
drug candidate
natural product
available
Drug Status
experimental
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
Cayman Chemical Bioactives
DrugBank
Selleckchem Bioactive Compound Library
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
21
Properties
(calculated by RDKit )
Molecular Weight
196.15
Hydrogen Bond Acceptors
2
Hydrogen Bond Donors
0
Rotatable Bonds
1
Ring Count
2
Aromatic Ring Count
0
cLogP
2.76
TPSA
26.3
Fraction CSP3
0.92
Chiral centers
3.0
Largest ring
5.0
QED
0.6
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
MOA
IL Receptor inhibitor
Pathway
Immunology/Inflammation
Apoptosis
Anti-infection
Target
IL Receptor
Fungal
Immunology & Inflammation related
Source data
