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Compound Detail

CHEMBL351805

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CCC(=O)C1=CCN(C)CC1

Basic Information

ChEMBL ID CHEMBL351805
Phase Preclinical
Structure Type MOL
InChI Key MZARYCDFEZUNDO-UHFFFAOYSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

153.2
MW (Da)
1.23
ALogP
2
HBA
0
HBD
20.3
PSA (Ų)
0.59
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 C9H15NO
MW 153.22
Aromatic Rings 0
Heavy Atoms 11
NP-Likeness 0.05

Activity Summary

Ki 1 meas. best 7.59

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Neuronal acetylcholine receptor
CHEMBL2094110
Ki 7.59 7.59 25.7 1

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
- 10.1016/S0960-894X(01)80157-8 Neuronal acetylcholine receptor 1
- 10.1016/S0960-894X(01)80157-8 Muscarinic acetylcholine receptor 1
- 10.1016/S0960-894X(01)80157-8 Unchecked 1

Data from ChEMBL 36 via Core Engine