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Compound Detail

CHEMBL610554

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C[C@H](NP(=O)(O)OC[C@H]1OC(n2ccc(N)nc2=O)[C@H](O)[C@@H]1O)C(=O)O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL610554
Phase Preclinical
Structure Type MOL
InChI Key UUEQDEICBVKJIL-TZMJUOFKSA-N
0
Targets
2
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

394.3
MW (Da)
-2.38
ALogP
10
HBA
6
HBD
206.5
PSA (Ų)
0.27
QED
1
Ro5 Violations
7
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C12H19N4O9P
MW 394.28
Aromatic Rings 1
Heavy Atoms 26
NP-Likeness 1.18

Activity Summary

Ki 2 meas.

Literature References

PubMed DOI Target Context # Activities
12482445 10.1016/s0960-894x(02)00735-7 CMP-N-acetylneuraminate-beta-1,4-galactoside alpha-2,3-sialyltransferase 1
12482445 10.1016/s0960-894x(02)00735-7 Beta-galactoside alpha-2,6-sialyltransferase 1 1

Data from ChEMBL 36 via Core Engine