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Compound Detail

CHEMBL332113

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Cn1c2nc3ccc(C#N)cc3c-2cc2cc(Cl)ccc21

Basic Information

ChEMBL ID CHEMBL332113
Phase Preclinical
Structure Type MOL
InChI Key POFNCSUIUKJWEJ-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
6
Publications
0
Known Names

Molecular Properties

291.7
MW (Da)
4.36
ALogP
3
HBA
0
HBD
41.6
PSA (Ų)
0.48
QED
0
Ro5 Violations
0
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C17H10ClN3
MW 291.74
Aromatic Rings 2
Heavy Atoms 21
NP-Likeness -1.53

Literature References

PubMed DOI Target Context # Activities
12139461 10.1021/jm011102i Plasmodium falciparum 2
12139461 10.1021/jm011102i MRC5 1
12139461 10.1021/jm011102i Trypanosoma brucei 1
12139461 10.1021/jm011102i Trypanosoma cruzi 1
12139461 10.1021/jm011102i Nucleic Acid 1
12139461 10.1021/jm011102i Histidine-rich protein PFHRP-II 1

Data from ChEMBL 36 via Core Engine