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Compound Detail

CHEMBL2385503

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COC(=O)c1cc(-c2ccc(Oc3ccccc3)cc2)nc2ccc(F)cc12

Basic Information

ChEMBL ID CHEMBL2385503
Phase Preclinical
Structure Type MOL
InChI Key YTZISGBVBQLBJE-UHFFFAOYSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

373.4
MW (Da)
5.62
ALogP
4
HBA
0
HBD
48.4
PSA (Ų)
0.44
QED
1
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C23H16FNO3
MW 373.38
Aromatic Rings 4
Heavy Atoms 28
NP-Likeness -1.14

Activity Summary

EC50 1 meas. best 4.06

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Vesicular stomatitis virus
CHEMBL613739
EC50 4.06 4.06 86460.0 1

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
23930152 10.1021/ml300464h Vesicular stomatitis virus 1

Data from ChEMBL 36 via Core Engine