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Compound Detail

CHEMBL4595218

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CCCCCCCCCC[n+]1c2c(n(CC(C)C)c1C)C(=O)c1ccccc1C2=O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4595218
Phase Preclinical
Structure Type MOL
InChI Key SESBXYIBKZJXQZ-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

409.6
MW (Da)
5.66
ALogP
3
HBA
0
HBD
43.0
PSA (Ų)
0.30
QED
1
Ro5 Violations
11
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C26H37N2O2+
MW 409.59
Aromatic Rings 2
Heavy Atoms 30
NP-Likeness -0.01

Data from ChEMBL 36 via Core Engine