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Compound Detail

CHEMBL3793346

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CSc1nc(-c2ccccc2)cc(-c2ccccc2)c1C#N
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3793346
Phase Preclinical
Structure Type MOL
InChI Key SVLOICMGJVRFED-UHFFFAOYSA-N
0
Targets
1
Activities
1
Assay Types
0
PK Parameters
5
Publications
0
Known Names

Molecular Properties

302.4
MW (Da)
5.01
ALogP
3
HBA
0
HBD
36.7
PSA (Ų)
0.64
QED
1
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C19H14N2S
MW 302.40
Aromatic Rings 3
Heavy Atoms 22
NP-Likeness -1.36

Activity Summary

IC50 1 meas.

Literature References

PubMed DOI Target Context # Activities
26924568 10.1021/acs.jmedchem.5b01935 ADMET 1
26924568 10.1021/acs.jmedchem.5b01935 Influenza A virus 1
26924568 10.1021/acs.jmedchem.5b01935 PA/PB1 1
26924568 10.1021/acs.jmedchem.5b01935 MDCK 1
26924568 10.1021/acs.jmedchem.5b01935 Unchecked 1

Data from ChEMBL 36 via Core Engine