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Compound Detail

CHEMBL1962747

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COc1ccc(-c2ncn(C)c2-c2cc(F)c(OC)c(F)c2)cc1F
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1962747
Phase Preclinical
Structure Type MOL
InChI Key VDPYTERAEYGFPQ-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

348.3
MW (Da)
4.19
ALogP
4
HBA
0
HBD
36.3
PSA (Ų)
0.71
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C18H15F3N2O2
MW 348.32
Aromatic Rings 3
Heavy Atoms 25
NP-Likeness -0.90

Data from ChEMBL 36 via Core Engine