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Compound Detail

CHEMBL1160765

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COC(=O)c1ccc(NC(=N)N)cc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1160765
Phase Preclinical
Structure Type MOL
InChI Key MNUVBGMYHJEDJB-UHFFFAOYSA-N
0
Targets
4
Activities
1
Assay Types
0
PK Parameters
6
Publications
0
Known Names

Molecular Properties

193.2
MW (Da)
0.78
ALogP
3
HBA
3
HBD
88.2
PSA (Ų)
0.37
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C9H11N3O2
MW 193.21
Aromatic Rings 1
Heavy Atoms 14
NP-Likeness -0.53

Activity Summary

Ki 4 meas.

Literature References

PubMed DOI Target Context # Activities
2231595 10.1021/jm00173a008 Urokinase-type plasminogen activator 2
2231595 10.1021/jm00173a008 Serine protease 1 2
2231595 10.1021/jm00173a008 Plasminogen 1
2231595 10.1021/jm00173a008 Prothrombin 1
2231595 10.1021/jm00173a008 Tissue-type plasminogen activator 1
2231595 10.1021/jm00173a008 Plasma kallikrein 1

Data from ChEMBL 36 via Core Engine