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Compound Detail

CHEMBL1651838

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O=P(O)(O)Cc1ccc(Cl)c(Cl)c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1651838
Phase Preclinical
Structure Type MOL
InChI Key QOTZMNSNGYSYQL-UHFFFAOYSA-N
0
Targets
1
Activities
1
Assay Types
0
PK Parameters
4
Publications
0
Known Names

Molecular Properties

241.0
MW (Da)
2.67
ALogP
1
HBA
2
HBD
57.5
PSA (Ų)
0.78
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C7H7Cl2O3P
MW 241.01
Aromatic Rings 1
Heavy Atoms 13
NP-Likeness -0.57

Activity Summary

Ki 1 meas.

Literature References

PubMed DOI Target Context # Activities
21561155 10.1021/jm200363d Unchecked 2
21379374 10.1021/ml100243r 1-deoxy-D-xylulose 5-phosphate reductoisomerase 1
21561155 10.1021/jm200363d 1-deoxy-D-xylulose 5-phosphate reductoisomerase 1
24378711 10.1016/j.ejmech.2013.11.028 Human immunodeficiency virus type 1 integrase 1

Data from ChEMBL 36 via Core Engine