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Compound Detail

CHEMBL4278576

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CC[C@H](Nc1nc(N[C@@H](CC)C(F)(F)F)nc(-c2cccc(C(F)(F)F)n2)n1)C(F)(F)F
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4278576
Phase Preclinical
Structure Type MOL
InChI Key QTQWJQDDICMREO-UWVGGRQHSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

476.4
MW (Da)
5.46
ALogP
6
HBA
2
HBD
75.6
PSA (Ų)
0.52
QED
1
Ro5 Violations
7
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C17H17F9N6
MW 476.35
Aromatic Rings 2
Heavy Atoms 32
NP-Likeness -0.79

Data from ChEMBL 36 via Core Engine