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Compound Detail

CHEMBL1449916

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Cc1ccc(NC(=S)c2nc3ccccc3s2)cc1

Basic Information

ChEMBL ID CHEMBL1449916
Phase Preclinical
Structure Type MOL
InChI Key QZYRZWIGCKUOJH-UHFFFAOYSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

284.4
MW (Da)
4.39
ALogP
3
HBA
1
HBD
24.9
PSA (Ų)
0.71
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 C15H12N2S2
MW 284.41
Aromatic Rings 3
Heavy Atoms 19
NP-Likeness -1.96

Activity Summary

EC50 1 meas. best 6.34

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Voltage-gated inwardly rectifying potassium channel KCNH2
CHEMBL240
EC50 6.34 6.34 460.0 1

Activity Data Samples

Top measurements by pChEMBL value

Data from ChEMBL 36 via Core Engine