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Compound Detail

CHEMBL92173

PHENYL DIPHENOXYPHOSPHINECARBOXYLATE OXIDE
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O=C(Oc1ccccc1)P(=O)(Oc1ccccc1)Oc1ccccc1

Basic Information

ChEMBL ID CHEMBL92173
Name PHENYL DIPHENOXYPHOSPHINECARBOXYLATE OXIDE
Phase Preclinical
Structure Type MOL
InChI Key BWTSONJQZUGZDC-UHFFFAOYSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

354.3
MW (Da)
5.54
ALogP
5
HBA
0
HBD
61.8
PSA (Ų)
0.54
QED
1
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C19H15O5P
MW 354.30
Aromatic Rings 3
Heavy Atoms 25
NP-Likeness -0.14

Activity Summary

IC50 1 meas. best 4.41

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
DNA polymerase catalytic subunit
CHEMBL1872
IC50 4.41 4.41 39000.0 1

Activity Data Samples

Top measurements by pChEMBL value

Target Type Rel. Value Units pChEMBL Assay PubMed
DNA polymerase catalytic subunit IC50 = 39000.0 nM 4.41 Inhibition of HSV-1 DNA polymerase in HSV-1 C42 plaque reduction assay 6298425

Literature References

PubMed DOI Target Context # Activities
6298425 10.1021/jm00356a028 DNA polymerase catalytic subunit 1
6298425 10.1021/jm00356a028 Human alphaherpesvirus 1 1

Data from ChEMBL 36 via Core Engine