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Compound Detail

CHEMBL567987

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Nc1nc2[nH]c(=O)c(C(=O)O)nc2c(=O)[nH]1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL567987
Phase Preclinical
Structure Type MOL
InChI Key WFICTSPBINOLJT-UHFFFAOYSA-N
0
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

223.2
MW (Da)
-1.71
ALogP
6
HBA
4
HBD
154.8
PSA (Ų)
0.45
QED
0
Ro5 Violations
1
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

Natural Product First in Class Prodrug

Extended Properties

Molecular Formula C7H5N5O4
MW 223.15
Aromatic Rings 2
Heavy Atoms 16
NP-Likeness -0.19

Activity Summary

IC50 1 meas.

Literature References

PubMed DOI Target Context # Activities
19899766 10.1021/jm900861d Dihydropteroate synthase 2

Data from ChEMBL 36 via Core Engine