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Compound Detail

CHEMBL2297581

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NC(=S)N/N=C\CCc1ccccc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL2297581
Phase Preclinical
Structure Type MOL
InChI Key PWBORPXUUJFWAE-WQLSENKSSA-N
0
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

207.3
MW (Da)
1.44
ALogP
2
HBA
2
HBD
50.4
PSA (Ų)
0.45
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C10H13N3S
MW 207.30
Aromatic Rings 1
Heavy Atoms 14
NP-Likeness -1.10

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