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Compound Detail

CHEMBL4069328

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C/C(=N\Nc1nnc(Cl)c2ccccc12)c1ccc(Cl)cc1Cl
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4069328
Phase Preclinical
Structure Type MOL
InChI Key FOPDRCFBAMCPLE-AWQFTUOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

365.6
MW (Da)
5.43
ALogP
4
HBA
1
HBD
50.2
PSA (Ų)
0.50
QED
1
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C16H11Cl3N4
MW 365.65
Aromatic Rings 3
Heavy Atoms 23
NP-Likeness -1.47

Literature References

PubMed DOI Target Context # Activities
28119201 10.1016/j.ejmech.2017.01.022 Leishmania braziliensis 2

Data from ChEMBL 36 via Core Engine