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Compound Detail

CHEMBL41118

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CN1CCC2(CC1)C/C(=N\OC(=O)c1ccccc1)CO2
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL41118
Phase Preclinical
Structure Type MOL
InChI Key XOZRWNAUBOZPOO-SAPNQHFASA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

288.4
MW (Da)
2.08
ALogP
5
HBA
0
HBD
51.1
PSA (Ų)
0.62
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C16H20N2O3
MW 288.35
Aromatic Rings 1
Heavy Atoms 21
NP-Likeness -0.30

Data from ChEMBL 36 via Core Engine