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Compound Detail

CHEMBL1490503

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CCOc1cc(S(=O)(=O)NCc2ccncc2)ccc1Cl

Basic Information

ChEMBL ID CHEMBL1490503
Phase Preclinical
Structure Type MOL
InChI Key ZLYULJKNCGHJHZ-UHFFFAOYSA-N
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

326.8
MW (Da)
2.61
ALogP
4
HBA
1
HBD
68.3
PSA (Ų)
0.89
QED
0
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C14H15ClN2O3S
MW 326.81
Aromatic Rings 2
Heavy Atoms 21
NP-Likeness -2.03

Activity Summary

IC50 2 meas. best 6.24

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Galanin receptor type 3
CHEMBL2731
IC50 6.24 6.24 580.9 1
COUP transcription factor 2
CHEMBL1961790
IC50 5.64 5.64 2287.0 1

Activity Data Samples

Top measurements by pChEMBL value

Data from ChEMBL 36 via Core Engine