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Compound Detail

CHEMBL126589

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Nc1nc2cc(O)ccc2[nH]1

Basic Information

ChEMBL ID CHEMBL126589
Phase Preclinical
Structure Type MOL
InChI Key FNSYWIPPPFVBAV-UHFFFAOYSA-N
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

149.2
MW (Da)
0.85
ALogP
3
HBA
3
HBD
74.9
PSA (Ų)
0.52
QED
0
Ro5 Violations
0
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

Natural Product First in Class Prodrug

Extended Properties

Molecular Formula C7H7N3O
MW 149.15
Aromatic Rings 2
Heavy Atoms 11
NP-Likeness 0.03

Activity Summary

IC50 2 meas. best 5.0

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Urokinase-type plasminogen activator
CHEMBL3286
IC50 5.0 4.35 10000.0 2

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
11052791 10.1021/jm0002228 Urokinase-type plasminogen activator 1
11052791 10.1021/jm0002228 No relevant target 1
18457385 10.1021/jm8000373 Urokinase-type plasminogen activator 1

Data from ChEMBL 36 via Core Engine