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Compound Detail

CHEMBL1195327

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COc1ccc2c(=O)n([C@@H]3CN4CCC3CC4)cc3c2c1CCC3
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1195327
Phase Preclinical
Structure Type MOL
InChI Key OJWRKJHAFNNPEK-QGZVFWFLSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

324.4
MW (Da)
2.77
ALogP
4
HBA
0
HBD
34.5
PSA (Ų)
0.85
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 C20H24N2O2
MW 324.42
Aromatic Rings 2
Heavy Atoms 24
NP-Likeness 0.18

Data from ChEMBL 36 via Core Engine