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Compound Detail

CHEMBL3727557

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Cn1nc(C(F)(F)F)cc1-c1ccc(NCc2ccc(F)cc2F)nc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3727557
Phase Preclinical
Structure Type MOL
InChI Key DTQCPVMYKXVJRV-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

368.3
MW (Da)
4.39
ALogP
4
HBA
1
HBD
42.7
PSA (Ų)
0.69
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 C17H13F5N4
MW 368.31
Aromatic Rings 3
Heavy Atoms 26
NP-Likeness -1.93

Data from ChEMBL 36 via Core Engine