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Compound Detail

CHEMBL5820065

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CNC(=O)c1cnc2c(S)cccc2c1

Basic Information

ChEMBL ID CHEMBL5820065
Phase Preclinical
Structure Type MOL
InChI Key ORZSODXEBNEOIA-UHFFFAOYSA-N
1
Targets
3
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

218.3
MW (Da)
1.88
ALogP
3
HBA
2
HBD
42.0
PSA (Ų)
0.72
QED
0
Ro5 Violations
1
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C11H10N2OS
MW 218.28
Aromatic Rings 2
Heavy Atoms 15
NP-Likeness -1.40

Activity Summary

IC50 3 meas. best 5.8

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Unchecked
CHEMBL612545
IC50 5.8 5.0967 1600.0 3

Activity Data Samples

Top measurements by pChEMBL value

Data from ChEMBL 36 via Core Engine