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Compound Detail

CHEMBL58319

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Oc1c(Cl)cc(Cl)cc1-c1n[nH]c(-c2ccccc2)n1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL58319
Phase Preclinical
Structure Type MOL
InChI Key KFLWNXDXVZHJCQ-UHFFFAOYSA-N
0
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

306.1
MW (Da)
4.15
ALogP
3
HBA
2
HBD
61.8
PSA (Ų)
0.75
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 C14H9Cl2N3O
MW 306.15
Aromatic Rings 3
Heavy Atoms 20
NP-Likeness -1.23

Activity Summary

IC50 1 meas.

Literature References

PubMed DOI Target Context # Activities
9873461 10.1016/s0960-894x(98)00325-4 KinA/Spo0F (sporulation kinase A/sporulation initiation phosphotransferase F) 1

Data from ChEMBL 36 via Core Engine