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Compound Detail

CHEMBL1610409

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Clc1ccccc1CSc1nnc(/C=C/c2ccccc2)o1

Basic Information

ChEMBL ID CHEMBL1610409
Phase Preclinical
Structure Type MOL
InChI Key NIDSYCJILKJDNL-ZHACJKMWSA-N
2
Targets
2
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

328.8
MW (Da)
5.19
ALogP
4
HBA
0
HBD
38.9
PSA (Ų)
0.60
QED
1
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C17H13ClN2OS
MW 328.82
Aromatic Rings 3
Heavy Atoms 22
NP-Likeness -1.39

Activity Summary

IC50 2 meas. best 5.16

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Neuropeptide Y receptor type 1
CHEMBL4777
IC50 5.16 5.16 6959.0 1
Neuropeptide Y receptor type 2
CHEMBL4018
IC50 5.09 5.09 8088.0 1

Activity Data Samples

Top measurements by pChEMBL value

Data from ChEMBL 36 via Core Engine