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Compound Detail

CHEMBL3410735

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O=C(Nc1cnc(O)nc1O)c1cccs1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3410735
Phase Preclinical
Structure Type MOL
InChI Key VTKLEBYPDWYLJQ-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

237.2
MW (Da)
1.20
ALogP
6
HBA
3
HBD
95.3
PSA (Ų)
0.73
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C9H7N3O3S
MW 237.24
Aromatic Rings 2
Heavy Atoms 16
NP-Likeness -1.96

Literature References

PubMed DOI Target Context # Activities
25581017 10.1021/jm5018187 Krueppel-like factor 10 2

Data from ChEMBL 36 via Core Engine