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Compound Detail

CHEMBL3325600

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Cc1ccc(N(C)C(=O)c2cn3c(-c4ccc(C(F)(F)F)cc4)cnc3cn2)nn1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3325600
Phase Preclinical
Structure Type MOL
InChI Key BKRRDBPGVOMBFE-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

412.4
MW (Da)
3.79
ALogP
6
HBA
0
HBD
76.3
PSA (Ų)
0.51
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C20H15F3N6O
MW 412.38
Aromatic Rings 4
Heavy Atoms 30
NP-Likeness -1.64

Literature References

PubMed DOI Target Context # Activities
25147620 10.1021/ml500244m Plasmodium yoelii 1
25147620 10.1021/ml500244m Plasmodium falciparum 1

Data from ChEMBL 36 via Core Engine