General
Preferred name
Peruviol
Synonyms
(??)-Nerolidol ()
NEROLIDOL ()
Peruviol(¡À)-Nerolidol ()
P&D ID
PD013648
CAS
7212-44-4
Tags
natural product
available
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
2
NPC Screening Collection
TargetMol Bioactive Compound Library
[[ a.name ]]
[[ ligand_id ]]
free of charge
External IDs
13
Properties
(calculated by RDKit )
Molecular Weight
222.2
Hydrogen Bond Acceptors
1
Hydrogen Bond Donors
1
Rotatable Bonds
7
Ring Count
0
Aromatic Ring Count
0
cLogP
4.4
TPSA
20.23
Fraction CSP3
0.6
Chiral centers
1.0
Largest ring
0.0
QED
0.63
Structural alerts
0
No structural alerts detected
Related compounds
Custom attributes
(extracted from source data)
Source data
