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Compound Detail

CHEMBL3728333

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Cc1cc2c(cc1-c1ccc(NCc3c(F)cc(F)cc3F)nc1)OC(F)(F)O2
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3728333
Phase Preclinical
Structure Type MOL
InChI Key ZAUMSRIEMSHLCO-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

408.3
MW (Da)
5.41
ALogP
4
HBA
1
HBD
43.4
PSA (Ų)
0.59
QED
1
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C20H13F5N2O2
MW 408.33
Aromatic Rings 3
Heavy Atoms 29
NP-Likeness -1.02

Data from ChEMBL 36 via Core Engine