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Compound Detail

CHEMBL3237968

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OC[C@H]1O[C@@H](c2nc(-c3ccc(C(F)(F)F)cc3)n[nH]2)[C@H](O)[C@@H](O)[C@@H]1O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3237968
Phase Preclinical
Structure Type MOL
InChI Key DRGPMAPBLAZFLD-RMPHRYRLSA-N
0
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

375.3
MW (Da)
0.01
ALogP
7
HBA
5
HBD
131.7
PSA (Ų)
0.51
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C15H16F3N3O5
MW 375.30
Aromatic Rings 2
Heavy Atoms 26
NP-Likeness -0.10

Activity Summary

Ki 1 meas.

Literature References

PubMed DOI Target Context # Activities
24608000 10.1016/j.ejmech.2014.02.041 Glycogen phosphorylase, muscle form 1

Data from ChEMBL 36 via Core Engine