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Compound Detail

CHEMBL892

UFIPRAZOLE
🧪 Phase II
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🧪 Phase II
COc1ccc2[nH]c(SCc3ncc(C)c(OC)c3C)nc2c1

Basic Information

ChEMBL ID CHEMBL892
Name UFIPRAZOLE
Phase Phase II
Structure Type MOL
InChI Key XURCIPRUUASYLR-UHFFFAOYSA-N

Known Names

Omeprazole sulfide Ufiprazol Ufiprazole
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
8
Publications
3
Known Names

Molecular Properties

329.4
MW (Da)
3.88
ALogP
5
HBA
1
HBD
60.0
PSA (Ų)
0.72
QED
0
Ro5 Violations
5
Rot. Bonds

Drug Information

Molecule Type Small molecule
Chirality Achiral

Flags

Natural Product
USAN Stem -prazole

Extended Properties

Molecular Formula C17H19N3O2S
MW 329.43
Aromatic Rings 3
Heavy Atoms 23
NP-Likeness -1.52

Activity Summary

EC50 1 meas. best 5.41

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Bombesin receptor subtype-3
CHEMBL4080
EC50 5.41 5.41 3900.0 1

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
8523404 10.1021/jm00025a008 Unchecked 3
18818070 10.1016/j.bmcl.2008.09.033 Bombesin receptor subtype-3 2
- 10.6019/CHEMBL4495565 SARS-CoV-2 2
- 10.6019/CHEMBL4808148 Histone deacetylase 6 2
9599229 10.1021/jm970165r Helicobacter pylori 1
9599229 10.1021/jm970165r No relevant target 1
- 10.21203/rs.3.rs-23951/v1 SARS-CoV-2 1
- 10.6019/CHEMBL4495564 Replicase polyprotein 1ab 1

Data from ChEMBL 36 via Core Engine