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Compound Detail

CHEMBL290462

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N=C(N)c1ccc2oc(-c3ccc(Oc4ccccc4)cc3)nc2c1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL290462
Phase Preclinical
Structure Type MOL
InChI Key WYOPGMZIVBZDGG-UHFFFAOYSA-N
0
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

329.4
MW (Da)
4.57
ALogP
4
HBA
2
HBD
85.1
PSA (Ų)
0.42
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C20H15N3O2
MW 329.36
Aromatic Rings 4
Heavy Atoms 25
NP-Likeness -0.98

Activity Summary

IC50 1 meas.

Literature References

PubMed DOI Target Context # Activities
11412977 10.1016/s0960-894x(01)00024-5 KinA/Spo0F (sporulation kinase A/sporulation initiation phosphotransferase F) 1

Data from ChEMBL 36 via Core Engine