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Compound Detail

CHEMBL2325173

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O=C(NCc1cccnc1)Nc1ccc2nnsc2c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL2325173
Phase Preclinical
Structure Type MOL
InChI Key JZNYLPMJOZJWIH-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

285.3
MW (Da)
2.41
ALogP
5
HBA
2
HBD
79.8
PSA (Ų)
0.77
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C13H11N5OS
MW 285.33
Aromatic Rings 3
Heavy Atoms 20
NP-Likeness -2.61

Literature References

PubMed DOI Target Context # Activities
23445220 10.1021/jm3018332 Protein arginine N-methyltransferase 3 1

Data from ChEMBL 36 via Core Engine