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Compound Detail

CHEMBL102009

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N=C(N)c1ccc2c(C(=O)c3ccccc3)c[nH]c2c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL102009
Phase Preclinical
Structure Type MOL
InChI Key FBPHAUFMIPKQEK-UHFFFAOYSA-N
0
Targets
2
Activities
1
Assay Types
0
PK Parameters
5
Publications
0
Known Names

Molecular Properties

263.3
MW (Da)
2.68
ALogP
2
HBA
3
HBD
82.7
PSA (Ų)
0.39
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 C16H13N3O
MW 263.30
Aromatic Rings 3
Heavy Atoms 20
NP-Likeness -0.24

Activity Summary

Ki 2 meas.

Literature References

PubMed DOI Target Context # Activities
6219223 10.1021/jm00356a036 Plasminogen 1
6219223 10.1021/jm00356a036 Urokinase-type plasminogen activator 1
6219223 10.1021/jm00356a036 Prothrombin 1
6219223 10.1021/jm00356a036 Serine protease 1 1
6219223 10.1021/jm00356a036 HEp-2 1

Data from ChEMBL 36 via Core Engine