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Compound Detail

CHEMBL149501

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[Cl-].c1cc(N2CCOCC2)ccc1-c1cc(-c2ccc(N3CCOCC3)cc2)[se+]c(-c2ccc(N3CCOCC3)cc2)c1

Basic Information

ChEMBL ID CHEMBL149501
Phase Preclinical
Structure Type MOL
InChI Key LFFCCBLSLUBUDP-UHFFFAOYSA-M
Parent Compound CHEMBL3558748
Active Moiety CHEMBL3558748
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
3
Publications
0
Known Names

Molecular Properties

627.7
MW (Da)

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C35H38ClN3O3Se
MW 663.12

Activity Summary

EC50 1 meas. best 6.1

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Colon 26
CHEMBL614466
EC50 6.1 6.1 800.0 1

Activity Data Samples

Top measurements by pChEMBL value

Target Type Rel. Value Units pChEMBL Assay PubMed
Colon 26 EC50 = 800.0 nM 6.1 Effective concentration evaluated in light induced toxicity toward COLO-26, muri... 12408723

Literature References

PubMed DOI Target Context # Activities
12408723 10.1021/jm020260m Colon 26 2
12408723 10.1021/jm020260m No relevant target 1
12408723 10.1021/jm020260m Unchecked 1

Data from ChEMBL 36 via Core Engine