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Compound Detail

CHEMBL1185521

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CCOC(=O)N(Cc1cccc[n+]1CC)C(C)=O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1185521
Phase Preclinical
Structure Type MOL
InChI Key QEPBKXRVQNUBMY-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

251.3
MW (Da)
1.50
ALogP
3
HBA
0
HBD
50.5
PSA (Ų)
0.76
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C13H19N2O3+
MW 251.31
Aromatic Rings 1
Heavy Atoms 18
NP-Likeness -0.55

Data from ChEMBL 36 via Core Engine