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Compound Detail

CHEMBL4555455

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O=C(Oc1ccccc1)c1ccccc1[Se][Se]c1ccccc1C(=O)Oc1ccccc1

Basic Information

ChEMBL ID CHEMBL4555455
Phase Preclinical
Structure Type MOL
InChI Key DEVNOZJAGASCKG-UHFFFAOYSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

552.4
MW (Da)

Drug Information

Molecule Type Unknown
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C26H18O4Se2
MW 552.35

Activity Summary

Ki 1 meas. best 6.28

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Unchecked
CHEMBL612545
Ki 6.28 6.28 528.0 1

Activity Data Samples

Top measurements by pChEMBL value

Target Type Rel. Value Units pChEMBL Assay PubMed
Unchecked Ki = 528.0 nM 6.28 Steady state inhibition of Sporosarcina pasteurii CCM 2056 urease using urea as ... 27524377

Literature References

PubMed DOI Target Context # Activities
27524377 10.1021/acs.jmedchem.6b00986 Urease subunit alpha/Urease subunit beta 4
27524377 10.1021/acs.jmedchem.6b00986 Unchecked 3

Data from ChEMBL 36 via Core Engine