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Compound Detail

CHEMBL1204825

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CC(C)c1ccc(/C(=C\C[C@H](N)C(=O)O)c2ccc(F)cc2F)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1204825
Phase Preclinical
Structure Type MOL
InChI Key ODWZNBOTFNAHQY-HVRVZBDQSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

345.4
MW (Da)
4.32
ALogP
2
HBA
2
HBD
63.3
PSA (Ų)
0.82
QED
0
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C20H21F2NO2
MW 345.39
Aromatic Rings 2
Heavy Atoms 25
NP-Likeness -0.30

Data from ChEMBL 36 via Core Engine