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Compound Detail

CHEMBL220283

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CC1=NN(c2ccc([N+](=O)[O-])cc2)C(=O)C1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL220283
Phase Preclinical
Structure Type MOL
InChI Key MYPAMGFTHVEING-UHFFFAOYSA-N
0
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

219.2
MW (Da)
1.71
ALogP
4
HBA
0
HBD
75.8
PSA (Ų)
0.56
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 C10H9N3O3
MW 219.20
Aromatic Rings 1
Heavy Atoms 16
NP-Likeness -1.50

Activity Summary

IC50 1 meas.

Literature References

PubMed DOI Target Context # Activities
16997555 10.1016/j.bmcl.2006.09.005 Unchecked 1

Data from ChEMBL 36 via Core Engine