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Compound Detail

CHEMBL325481

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CCOCn1cc(C(=N)S)c2cncnc21
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL325481
Phase Preclinical
Structure Type MOL
InChI Key KBZFPKMRLZQRIR-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

236.3
MW (Da)
1.68
ALogP
5
HBA
2
HBD
63.8
PSA (Ų)
0.48
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 C10H12N4OS
MW 236.30
Aromatic Rings 2
Heavy Atoms 16
NP-Likeness -0.87

Literature References

PubMed DOI Target Context # Activities
8784444 10.1021/jm950835y Human betaherpesvirus 5 1

Data from ChEMBL 36 via Core Engine