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Compound Detail

CHEMBL132995

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CC(C)C[C@H](NC(=O)NNC(=O)OCc1ccccc1)C(N)=O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL132995
Phase Preclinical
Structure Type MOL
InChI Key OFFLVIOSLSTARL-LBPRGKRZSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

322.4
MW (Da)
1.03
ALogP
4
HBA
4
HBD
122.5
PSA (Ų)
0.58
QED
0
Ro5 Violations
6
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C15H22N4O4
MW 322.37
Aromatic Rings 1
Heavy Atoms 23
NP-Likeness -0.94

Literature References

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

Data from ChEMBL 36 via Core Engine