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Compound Detail

CHEMBL4117192

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COc1ccc(F)cc1C1CC1CNCc1ccccc1OCCF
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4117192
Phase Preclinical
Structure Type MOL
InChI Key RWVUVCPDTBPDCJ-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

347.4
MW (Da)
4.08
ALogP
3
HBA
1
HBD
30.5
PSA (Ų)
0.74
QED
0
Ro5 Violations
9
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C20H23F2NO2
MW 347.41
Aromatic Rings 2
Heavy Atoms 25
NP-Likeness -0.55

Data from ChEMBL 36 via Core Engine