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Compound Detail

CHEMBL126637

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C[N+]1(C)CCCCC1CN1CCCCC1=O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL126637
Phase Preclinical
Structure Type MOL
InChI Key CGLXAXCGJGNUJX-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

225.4
MW (Da)
1.63
ALogP
1
HBA
0
HBD
20.3
PSA (Ų)
0.65
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C13H25N2O+
MW 225.36
Aromatic Rings 0
Heavy Atoms 16
NP-Likeness 0.31

Literature References

PubMed DOI Target Context # Activities
14552793 10.1016/s0960-894x(03)00728-5 Neuronal acetylcholine receptor 2

Data from ChEMBL 36 via Core Engine