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Compound Detail

CHEMBL4793526

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Oc1ccc(Cc2nnc3sc(Nc4ccccc4)nn23)cc1

Basic Information

ChEMBL ID CHEMBL4793526
Phase Preclinical
Structure Type MOL
InChI Key LQCXQMQVIZTAEQ-UHFFFAOYSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

323.4
MW (Da)
3.23
ALogP
7
HBA
2
HBD
75.3
PSA (Ų)
0.60
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C16H13N5OS
MW 323.38
Aromatic Rings 4
Heavy Atoms 23
NP-Likeness -1.78

Activity Summary

Ki 1 meas. best 7.52

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Hepatocyte growth factor receptor
CHEMBL3717
Ki 7.52 7.52 30.0 1

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
34141080 10.1021/acsmedchemlett.1c00094 Hepatocyte growth factor receptor 2
34141080 10.1021/acsmedchemlett.1c00094 ADMET 2

Data from ChEMBL 36 via Core Engine