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Compound Detail

CHEMBL566922

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Nc1nnc(N)c2[nH]cnc12
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL566922
Phase Preclinical
Structure Type MOL
InChI Key UMLCZSAOYUCVKU-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

150.1
MW (Da)
-0.48
ALogP
5
HBA
3
HBD
106.5
PSA (Ų)
0.47
QED
0
Ro5 Violations
0
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C5H6N6
MW 150.14
Aromatic Rings 2
Heavy Atoms 11
NP-Likeness -0.33

Literature References

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

Data from ChEMBL 36 via Core Engine