General
Preferred name
NORNICOTINE
Synonyms
(±)-Nornicotine ()
(±)-Nornicotine-d4 ()
P&D ID
PD003066
CAS
5746-86-1
494-97-3
66148-18-3
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)
DESCRIPTION Nornicotine is a neuronal nicotinic acetylcholine receptor agonist. (Enamine Bioactive Compounds)
Compound Sets
4
Cayman Chemical Bioactives
Enamine Bioactive Compounds
Enamine BioReference Compounds
NIH Clinical Collections (NCC)
External IDs
30
Properties
(calculated by RDKit )
Molecular Weight
148.1
Hydrogen Bond Acceptors
2
Hydrogen Bond Donors
1
Rotatable Bonds
1
Ring Count
2
Aromatic Ring Count
1
cLogP
1.51
TPSA
24.92
Fraction CSP3
0.44
Chiral centers
1.0
Largest ring
6.0
QED
0.65
Structural alerts
0
No structural alerts detected
Custom attributes
(extracted from source data)
Source data