General
Preferred name
PHELLAMURIN
Synonyms
P&D ID
PD162344
CAS
52589-11-4
Tags
available
Structure
Probe scores
P&D probe-likeness score
[[ v.score ]]%
Structure formats
[[ format ]]
[[ compound[format === 'MOL' ? 'molblock' : format.toLowerCase()] ]]
Description
(extracted from source data)
PRICE 504
DESCRIPTION Phellamurin inhibits intestinal P-glycoprotein in a dose-dependent manner, there is a serious interaction occurred between Phellamurin with cyclosporin, to ensure the efficacy of cyclosporin, we suggest that the coadministration of Phellamurin or Phellodendron wilsonii with cyclosporin should be avoided. (TargetMol Bioactive Compound Library)
Compound Sets
2
ReFrame library
TargetMol Bioactive Compound Library
TN4761
External IDs
21
Properties
(calculated by RDKit )
Molecular Weight
518.18
Hydrogen Bond Acceptors
11
Hydrogen Bond Donors
7
Rotatable Bonds
6
Ring Count
4
Aromatic Ring Count
2
cLogP
0.46
TPSA
186.37
Fraction CSP3
0.42
Chiral centers
7.0
Largest ring
6.0
QED
0.26
Structural alerts
0
No structural alerts detected
Custom attributes
(extracted from source data)
Target
P-gp
Pathway
Membrane Transporter/Ion Channel
Neuroscience
Source data