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Compound Detail

CHEMBL4211729

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CC(=O)Nc1ccccc1C(F)(F)C(=O)NNc1ccccn1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4211729
Phase Preclinical
Structure Type MOL
InChI Key RQFSJEAXZYRFMR-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

320.3
MW (Da)
2.28
ALogP
4
HBA
3
HBD
83.1
PSA (Ų)
0.74
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C15H14F2N4O2
MW 320.30
Aromatic Rings 2
Heavy Atoms 23
NP-Likeness -1.56

Literature References

PubMed DOI Target Context # Activities
31311700 10.1016/j.bmc.2019.07.022 Arginase 4
29407978 10.1016/j.ejmech.2018.01.071 Mycobacterium tuberculosis 1
31311700 10.1016/j.bmc.2019.07.022 Leishmania amazonensis 1

Data from ChEMBL 36 via Core Engine