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Compound Detail

CHEMBL2297595

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COc1ccc(/C=N\NC(N)=S)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL2297595
Phase Preclinical
Structure Type MOL
InChI Key TUNWURMRBJWUFJ-WDZFZDKYSA-N
0
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

209.3
MW (Da)
0.86
ALogP
3
HBA
2
HBD
59.6
PSA (Ų)
0.44
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

Natural Product First in Class Prodrug

Extended Properties

Molecular Formula C9H11N3OS
MW 209.27
Aromatic Rings 1
Heavy Atoms 14
NP-Likeness -1.81

Activity Summary

IC50 1 meas.

Literature References

PubMed DOI Target Context # Activities
- 10.1007/s00044-012-0208-6 Trypanosoma brucei brucei 1

Data from ChEMBL 36 via Core Engine