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Compound Detail

CHEMBL415700

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

Basic Information

ChEMBL ID CHEMBL415700
Phase Preclinical
Structure Type MOL
InChI Key AZRVNXNXIKKREH-UHFFFAOYSA-N
0
Targets
1
Activities
1
Assay Types
0
PK Parameters
5
Publications
0
Known Names

Molecular Properties

255.2
MW (Da)
2.20
ALogP
2
HBA
3
HBD
82.7
PSA (Ų)
0.44
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 C11H8F3N3O
MW 255.20
Aromatic Rings 2
Heavy Atoms 18
NP-Likeness -0.45

Activity Summary

Ki 1 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