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Compound Detail

CHEMBL1630295

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CC(C)(C)OC1=NO[C@H]([C@@H]2CCCN2)C1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1630295
Phase Preclinical
Structure Type MOL
InChI Key LAUIYVZDKSCUAB-IUCAKERBSA-N
0
Targets
1
Activities
1
Assay Types
0
PK Parameters
7
Publications
0
Known Names

Molecular Properties

212.3
MW (Da)
1.66
ALogP
4
HBA
1
HBD
42.9
PSA (Ų)
0.72
QED
0
Ro5 Violations
1
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C11H20N2O2
MW 212.29
Aromatic Rings 0
Heavy Atoms 15
NP-Likeness 0.36

Activity Summary

Ki 1 meas.

Literature References

PubMed DOI Target Context # Activities
20932609 10.1016/j.ejmech.2010.09.009 Neuronal acetylcholine receptor; alpha4/beta2 1
20932609 10.1016/j.ejmech.2010.09.009 Neuronal acetylcholine receptor subunit alpha-7 1
20932609 10.1016/j.ejmech.2010.09.009 Muscarinic acetylcholine receptor M1 1
20932609 10.1016/j.ejmech.2010.09.009 Muscarinic acetylcholine receptor M2 1
20932609 10.1016/j.ejmech.2010.09.009 Muscarinic acetylcholine receptor M3 1
20932609 10.1016/j.ejmech.2010.09.009 Muscarinic acetylcholine receptor M4 1
20932609 10.1016/j.ejmech.2010.09.009 Muscarinic acetylcholine receptor M5 1

Data from ChEMBL 36 via Core Engine