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Compound Detail

CHEMBL4294406

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CC(F)(F)c1cc(Nc2nc(N[C@@H]3CCC(F)(F)C3)nc(-c3cccc(C(F)(F)F)n3)n2)ccn1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4294406
Phase Preclinical
Structure Type MOL
InChI Key RJZGABPOSOZJRY-GFCCVEGCSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

501.4
MW (Da)
5.80
ALogP
7
HBA
2
HBD
88.5
PSA (Ų)
0.41
QED
2
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C21H18F7N7
MW 501.41
Aromatic Rings 3
Heavy Atoms 35
NP-Likeness -0.95

Data from ChEMBL 36 via Core Engine