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Compound Detail

CHEMBL30669

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CCOC(=O)CCCCCC[N+](C)(C)CCCN1C(=O)c2ccccc2C1=O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL30669
Phase Preclinical
Structure Type MOL
InChI Key YXJQGHRGFARCCP-UHFFFAOYSA-N
0
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

389.5
MW (Da)
3.26
ALogP
4
HBA
0
HBD
63.7
PSA (Ų)
0.24
QED
0
Ro5 Violations
12
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C22H33N2O4+
MW 389.52
Aromatic Rings 1
Heavy Atoms 28
NP-Likeness -0.24

Activity Summary

EC50 1 meas.

Literature References

PubMed DOI Target Context # Activities
12672239 10.1021/jm021077w Muscarinic acetylcholine receptor M2 1

Data from ChEMBL 36 via Core Engine