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Compound Detail

CHEMBL151349

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CC(=O)C1=CC[N+](C)(C)CC1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL151349
Phase Preclinical
Structure Type MOL
InChI Key JQYLFBUJZPXFGF-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

154.2
MW (Da)
0.98
ALogP
1
HBA
0
HBD
17.1
PSA (Ų)
0.51
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 C9H16NO+
MW 154.23
Aromatic Rings 0
Heavy Atoms 11
NP-Likeness 1.05

Literature References

PubMed DOI Target Context # Activities
3258034 10.1021/jm00398a010 Unchecked 1
2913294 10.1021/jm00122a006 Unchecked 1

Data from ChEMBL 36 via Core Engine