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Compound Detail

CHEMBL1469130

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O=C(NC1CC1)C1Nc2ccc(OC(F)(F)F)cc2C2C=CCC12
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1469130
Phase Preclinical
Structure Type MOL
InChI Key UFNAFOTWOKHFSY-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

338.3
MW (Da)
3.32
ALogP
3
HBA
2
HBD
50.4
PSA (Ų)
0.83
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C17H17F3N2O2
MW 338.33
Aromatic Rings 1
Heavy Atoms 24
NP-Likeness -0.65

Data from ChEMBL 36 via Core Engine