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Compound Detail

CHEMBL167892

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CN(C)CC#CC1CCC(=O)N1C
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL167892
Phase Preclinical
Structure Type MOL
InChI Key GIXNSQJALPPKCL-UHFFFAOYSA-N
0
Targets
2
Activities
2
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

180.2
MW (Da)
0.17
ALogP
2
HBA
0
HBD
23.6
PSA (Ų)
0.54
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 C10H16N2O
MW 180.25
Aromatic Rings 0
Heavy Atoms 13
NP-Likeness -0.23

Activity Summary

Kd 1 meas.
Ki 1 meas.

Literature References

PubMed DOI Target Context # Activities
2704032 10.1021/jm00124a022 Cavia porcellus 3
2704032 10.1021/jm00124a022 Mus musculus 1
2704032 10.1021/jm00124a022 Muscarinic acetylcholine receptor 1

Data from ChEMBL 36 via Core Engine