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Compound Detail

CHEMBL417194

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O=P(O)(O)C(Nc1nc2ccccc2s1)P(=O)(O)O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL417194
Phase Preclinical
Structure Type MOL
InChI Key WDRFJYZCRXWXDE-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
4
Publications
0
Known Names

Molecular Properties

324.2
MW (Da)
1.35
ALogP
5
HBA
5
HBD
140.0
PSA (Ų)
0.53
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 C8H10N2O6P2S
MW 324.19
Aromatic Rings 2
Heavy Atoms 19
NP-Likeness -1.29

Literature References

PubMed DOI Target Context # Activities
14695831 10.1021/jm030084x Entamoeba histolytica 1
14695831 10.1021/jm030084x Plasmodium falciparum 1
14695831 10.1021/jm030084x KB 1
12166945 10.1021/jm020819i Rattus norvegicus 1

Data from ChEMBL 36 via Core Engine