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Compound Detail

CHEMBL2376548

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Clc1cccc(Cl)c1C(c1c[nH]c2ccc(I)cc12)c1c[nH]c2ccc(I)cc12
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL2376548
Phase Preclinical
Structure Type MOL
InChI Key FSUHLTXXRTWTON-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

643.1
MW (Da)
8.35
ALogP
0
HBA
2
HBD
31.6
PSA (Ų)
0.19
QED
2
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C23H14Cl2I2N2
MW 643.09
Aromatic Rings 5
Heavy Atoms 29
NP-Likeness -0.69

Literature References

PubMed DOI Target Context # Activities
23517732 10.1016/j.ejmech.2013.02.024 Leishmania donovani 4
23517732 10.1016/j.ejmech.2013.02.024 Vero 1

Data from ChEMBL 36 via Core Engine