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Compound Detail

CHEMBL223954

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BP(=O)(OC[C@@H]1O[C@H](n2cc(C)c(=O)[nH]c2=O)C[C@H]1N=[N+]=[N-])OP(=O)(O)C(F)P(=O)(O)O

Basic Information

ChEMBL ID CHEMBL223954
Phase Preclinical
Structure Type MOL
InChI Key URRCZGYIKMVDGV-USIPZMFLSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

519.0
MW (Da)

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C11H18BFN5O11P3
MW 519.02

Activity Summary

Ki 1 meas. best 7.57

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Unchecked
CHEMBL612545
Ki 7.57 7.57 27.0 1

Activity Data Samples

Top measurements by pChEMBL value

Target Type Rel. Value Units pChEMBL Assay PubMed
Unchecked Ki = 27.0 nM 7.57 Inhibition of HIV1 reverse transcriptase 15615539

Literature References

PubMed DOI Target Context # Activities
15615539 10.1021/jm040116w Unchecked 3

Data from ChEMBL 36 via Core Engine