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Compound Detail

CHEMBL5414917

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COc1ccc(NC(=O)c2ccc(-c3ccnnc3)nn2)c(C(=O)O)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5414917
Phase Preclinical
Structure Type MOL
InChI Key HAVGUIFTGOZMMZ-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

351.3
MW (Da)
1.89
ALogP
7
HBA
2
HBD
127.2
PSA (Ų)
0.71
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C17H13N5O4
MW 351.32
Aromatic Rings 3
Heavy Atoms 26
NP-Likeness -1.37

Literature References

PubMed DOI Target Context # Activities
36808996 10.1021/acs.jmedchem.2c01714 Stimulator of interferon genes protein 2

Data from ChEMBL 36 via Core Engine