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Compound Detail

CHEMBL2113996

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Cc1c(-c2nc(C(=O)O)co2)cnn1-c1ccc(F)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL2113996
Phase Preclinical
Structure Type MOL
InChI Key WPAXFMQFJQZBFD-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

287.2
MW (Da)
2.67
ALogP
5
HBA
1
HBD
81.2
PSA (Ų)
0.80
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 C14H10FN3O3
MW 287.25
Aromatic Rings 3
Heavy Atoms 21
NP-Likeness -1.74

Literature References

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

Data from ChEMBL 36 via Core Engine