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Compound Detail

CHEMBL358937

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C=CCOC(=O)c1ccc2[nH]c(NC(=O)OC)nc2c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL358937
Phase Preclinical
Structure Type MOL
InChI Key ZXIYNEAJMIXIIV-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

275.3
MW (Da)
2.08
ALogP
5
HBA
2
HBD
93.3
PSA (Ų)
0.66
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C13H13N3O4
MW 275.26
Aromatic Rings 2
Heavy Atoms 20
NP-Likeness -0.95

Literature References

PubMed DOI Target Context # Activities
1738146 10.1021/jm00081a016 L1210 2
1738146 10.1021/jm00081a016 Brugia pahangi 1

Data from ChEMBL 36 via Core Engine