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Compound Detail

CHEMBL3219020

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NC(=O)c1sc2ccccc2c1O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3219020
Phase Preclinical
Structure Type MOL
InChI Key HTILUUALMNRENB-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

193.2
MW (Da)
1.71
ALogP
3
HBA
2
HBD
63.3
PSA (Ų)
0.72
QED
0
Ro5 Violations
1
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C9H7NO2S
MW 193.23
Aromatic Rings 2
Heavy Atoms 13
NP-Likeness -1.21

Literature References

PubMed DOI Target Context # Activities
- 10.1039/C1MD00137J LIM domain kinase 1 1

Data from ChEMBL 36 via Core Engine