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Compound Detail

CHEMBL3727596

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CCc1ccccc1Oc1ccc(NCc2c(F)cccc2F)nc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3727596
Phase Preclinical
Structure Type MOL
InChI Key FQPAYCMWWYSEKT-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

340.4
MW (Da)
5.33
ALogP
3
HBA
1
HBD
34.1
PSA (Ų)
0.66
QED
1
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C20H18F2N2O
MW 340.37
Aromatic Rings 3
Heavy Atoms 25
NP-Likeness -1.48

Data from ChEMBL 36 via Core Engine