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Compound Detail

CHEMBL4804034

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CCCOc1ccc2oc(CC)cc2c1[C@H]1C[C@@H]1CN
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4804034
Phase Preclinical
Structure Type MOL
InChI Key NGMJOSJMPXNSEZ-YPMHNXCESA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

273.4
MW (Da)
3.85
ALogP
3
HBA
1
HBD
48.4
PSA (Ų)
0.87
QED
0
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C17H23NO2
MW 273.38
Aromatic Rings 2
Heavy Atoms 20
NP-Likeness 0.29

Data from ChEMBL 36 via Core Engine