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Compound Detail

CHEMBL3545832

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COC(=O)C12CC3CC(CC(N)(C3)C1)C2
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3545832
Phase Preclinical
Structure Type MOL
InChI Key YCDFPJJVFUVJJF-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

209.3
MW (Da)
1.46
ALogP
3
HBA
1
HBD
52.3
PSA (Ų)
0.67
QED
0
Ro5 Violations
1
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C12H19NO2
MW 209.29
Aromatic Rings 0
Heavy Atoms 15
NP-Likeness 0.30

Data from ChEMBL 36 via Core Engine