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Compound Detail

CHEMBL105755

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O=C(NCCO)[C@@H]1OC(CO)C(O)C(O)C1O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL105755
Phase Preclinical
Structure Type MOL
InChI Key HGJZPXBVSWPHRZ-WTZNIHQSSA-N
0
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

251.2
MW (Da)
-4.06
ALogP
7
HBA
6
HBD
139.5
PSA (Ų)
0.30
QED
1
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C9H17NO7
MW 251.24
Aromatic Rings 0
Heavy Atoms 17
NP-Likeness 1.21

Activity Summary

Ki 1 meas.

Literature References

PubMed DOI Target Context # Activities
15163189 10.1021/jm030586a Glycogen phosphorylase, brain form 1

Data from ChEMBL 36 via Core Engine