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Compound Detail

CHEMBL4803705

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CCOc1ccc2c(c1[C@@H]1C[C@H]1CN)CCO2
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4803705
Phase Preclinical
Structure Type MOL
InChI Key ZFGDZQUAQZGADF-GXSJLCMTSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

233.3
MW (Da)
2.08
ALogP
3
HBA
1
HBD
44.5
PSA (Ų)
0.87
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C14H19NO2
MW 233.31
Aromatic Rings 1
Heavy Atoms 17
NP-Likeness 0.28

Data from ChEMBL 36 via Core Engine