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Compound Detail

CHEMBL2113985

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NC(=O)COC(=O)c1cnn(-c2ccc(F)cc2)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL2113985
Phase Preclinical
Structure Type MOL
InChI Key DNDQGXCXOJEWIK-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

263.2
MW (Da)
0.65
ALogP
5
HBA
1
HBD
87.2
PSA (Ų)
0.82
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 C12H10FN3O3
MW 263.23
Aromatic Rings 2
Heavy Atoms 19
NP-Likeness -2.33

Literature References

PubMed DOI Target Context # Activities
- 10.6019/CHEMBL2113921 Plasmodium falciparum 1

Data from ChEMBL 36 via Core Engine