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Compound Detail

CHEMBL369767

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CCNc1nc(-c2ccccc2)cs1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL369767
Phase Preclinical
Structure Type MOL
InChI Key GBPDSPQBKICWRK-UHFFFAOYSA-N
0
Targets
2
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

204.3
MW (Da)
3.24
ALogP
3
HBA
1
HBD
24.9
PSA (Ų)
0.83
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C11H12N2S
MW 204.30
Aromatic Rings 2
Heavy Atoms 14
NP-Likeness -2.01

Activity Summary

EC50 2 meas.

Literature References

PubMed DOI Target Context # Activities
15225722 10.1016/j.bmcl.2004.05.044 Haemonchus contortus 2

Data from ChEMBL 36 via Core Engine