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Compound Detail

CHEMBL3142758

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C=CCn1c(=O)c(C)cn([C@@H]2O[C@H](CO[Si](C)(C)C(C)(C)C)[C@@]3(OS(=O)(=O)C=C3N)[C@H]2O[Si](C)(C)C(C)(C)C)c1=O

Basic Information

ChEMBL ID CHEMBL3142758
Phase Preclinical
Structure Type MOL
InChI Key ZYAASSGDSGTPCS-MGUUAAOPSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

629.9
MW (Da)

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C27H47N3O8SSi2
MW 629.93

Activity Summary

EC50 1 meas. best 6.63

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
MT4
CHEMBL388
EC50 6.63 6.63 233.0 1

Activity Data Samples

Top measurements by pChEMBL value

Target Type Rel. Value Units pChEMBL Assay PubMed
MT4 EC50 = 233.0 nM 6.63 Concentration required to inhibit HIV-1 induced cytopathicity in MT-4 cells by 5... 1501224

Literature References

PubMed DOI Target Context # Activities
1501224 10.1021/jm00094a009 MT4 2
1501224 10.1021/jm00094a009 Unchecked 1

Data from ChEMBL 36 via Core Engine