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Compound Detail

CHEMBL5818564

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CC(=O)NS(=O)(=O)c1ccc(C2CCCCN2Cc2c(C3CC3)cc(C)c3[nH]ccc23)cc1

Basic Information

ChEMBL ID CHEMBL5818564
Phase Preclinical
Structure Type MOL
InChI Key FWYZUPXAMMREFF-UHFFFAOYSA-N
1
Targets
2
Activities
1
Assay Types
0
PK Parameters
0
Publications
0
Known Names

Molecular Properties

465.6
MW (Da)
4.91
ALogP
4
HBA
2
HBD
82.3
PSA (Ų)
0.54
QED
0
Ro5 Violations
6
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C26H31N3O3S
MW 465.62
Aromatic Rings 3
Heavy Atoms 33
NP-Likeness -0.66

Activity Summary

IC50 2 meas. best 10.22

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Complement factor B
CHEMBL5731
IC50 10.22 8.74 0.1 2

Activity Data Samples

Top measurements by pChEMBL value

Data from ChEMBL 36 via Core Engine