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Compound Detail

CHEMBL1160830

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

Basic Information

ChEMBL ID CHEMBL1160830
Phase Preclinical
Structure Type MOL
InChI Key AVDOUEOFSCXBTB-CWWBUFHZSA-N
0
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

236.2
MW (Da)
-4.14
ALogP
7
HBA
6
HBD
145.3
PSA (Ų)
0.29
QED
1
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C8H16N2O6
MW 236.22
Aromatic Rings 0
Heavy Atoms 16
NP-Likeness 1.29

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