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Compound Detail

CHEMBL131902

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C[C@@H](NC(=O)[C@H](Cc1ccccc1)C1OO1)C(=O)NCC(N)=O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL131902
Phase Preclinical
Structure Type MOL
InChI Key PZQPTAKJAAPSBI-KOLCDFICSA-N
0
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

321.3
MW (Da)
-0.76
ALogP
5
HBA
3
HBD
126.3
PSA (Ų)
0.43
QED
0
Ro5 Violations
8
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C15H19N3O5
MW 321.33
Aromatic Rings 1
Heavy Atoms 23
NP-Likeness -0.20

Activity Summary

Ki 1 meas.

Literature References

PubMed DOI Target Context # Activities
12213058 10.1021/jm020808p Glycogen phosphorylase, brain form 1

Data from ChEMBL 36 via Core Engine