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Compound Detail

CHEMBL4802388

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CCOc1ccc2oc(CC)cc2c1[C@H]1C[C@@H]1CN
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4802388
Phase Preclinical
Structure Type MOL
InChI Key GWHZFMHFKIWRGJ-PWSUYJOCSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

259.4
MW (Da)
3.46
ALogP
3
HBA
1
HBD
48.4
PSA (Ų)
0.89
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C16H21NO2
MW 259.35
Aromatic Rings 2
Heavy Atoms 19
NP-Likeness 0.25

Data from ChEMBL 36 via Core Engine