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Compound Detail

CHEMBL298986

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Oc1[nH]c(Nc2ccc(F)cc2)nc2ncnc1-2
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL298986
Phase Preclinical
Structure Type MOL
InChI Key PMAXALSSLOGZST-UHFFFAOYSA-N
0
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

245.2
MW (Da)
1.89
ALogP
5
HBA
3
HBD
86.7
PSA (Ų)
0.64
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 C11H8FN5O
MW 245.22
Aromatic Rings 1
Heavy Atoms 18
NP-Likeness -1.30

Activity Summary

IC50 2 meas.

Literature References

PubMed DOI Target Context # Activities
1323680 10.1021/jm00094a007 Thymidine kinase 2
7752206 10.1021/jm00010a027 DNA helicase/primase complex protein 1

Data from ChEMBL 36 via Core Engine