General
Preferred name
N-Nornuciferine
Synonyms
N-Nornuciferine hydrochloride ()
N-Nornuciferine hydrochloride(4846-19-9 free base) ()
P&D ID
PD100412
CAS
4846-19-9
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 342
DESCRIPTION N-Nornuciferine hydrochloride(4846-19-9 free base) (N-Nornuciferine hydrochloride) is an aporphine alkaloid in lotus leaf, significantly inhibits CYP2D6 (IC50: 3.76 ??M, Ki: 2.34 ??M).
DESCRIPTION N-Nornuciferine hydrochloride(4846-19-9 free base) (N-Nornuciferine hydrochloride) is an aporphine alkaloid in lotus leaf, significantly inhibits CYP2D6 (IC50: 3.76 μM, Ki: 2.34 μM). (TargetMol Bioactive Compound Library)
Compound Sets
4
Cayman Chemical Bioactives
MedChem Express Bioactive Compound Library
Selleckchem Bioactive Compound Library
TargetMol Bioactive Compound Library
External IDs
17
Properties
(calculated by RDKit )
Molecular Weight
281.14
Hydrogen Bond Acceptors
3
Hydrogen Bond Donors
1
Rotatable Bonds
2
Ring Count
4
Aromatic Ring Count
2
cLogP
3.11
TPSA
30.49
Fraction CSP3
0.33
Chiral centers
1.0
Largest ring
6.0
QED
0.92
Structural alerts
0
No structural alerts detected
Custom attributes
(extracted from source data)
Target
CYP2D6
Cytochrome P450
Pathway
Metabolic Enzyme/Protease
Metabolism
Source data