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Compound Detail

CHEMBL222422

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NC(=O)c1cccc(NC(=O)COc2ccc([N+](=O)[O-])cc2)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL222422
Phase Preclinical
Structure Type MOL
InChI Key ZRPMTAVNBAYLQJ-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

315.3
MW (Da)
1.71
ALogP
5
HBA
2
HBD
124.6
PSA (Ų)
0.62
QED
0
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C15H13N3O5
MW 315.29
Aromatic Rings 2
Heavy Atoms 23
NP-Likeness -1.98

Literature References

PubMed DOI Target Context # Activities
17328532 10.1021/jm0610292 Hypoxia inducible factors; HIF-1-alpha, HIF-2-alpha 1
17328532 10.1021/jm0610292 AGS 1

Data from ChEMBL 36 via Core Engine