Skip to main content
Free research Free research Free compound review with research home and workspace preview
Quick search ChEMBL 36
Compound Detail

CHEMBL3343357

Enter ChEMBL ID:
Free Research Context This compound will appear in recent viewed items on the research home for this browser.
Research home View demo workspace
C[C@@H]1O[C@H](n2cc(COP(=O)(O)OP(=O)([O-])OC[C@H]3O[C@@H](n4cnc5c(=O)[nH]c(N)nc54)[C@H](O)[C@@H]3O)nn2)[C@@H](O)[C@H](O)[C@@H]1O.[Na+]
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3343357
Phase Preclinical
Structure Type MOL
InChI Key XJLIGSLRXNRSKM-MMNWUFHOSA-M
Parent Compound CHEMBL3558480
Active Moiety CHEMBL3558480
0
Targets
2
Activities
2
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

670.4
MW (Da)
-3.64
ALogP
20
HBA
9
HBD
342.2
PSA (Ų)
0.09
QED
3
Ro5 Violations
10
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C19H27N8NaO15P2
MW 692.40
Aromatic Rings 3
Heavy Atoms 44
NP-Likeness 0.71

Activity Summary

IC50 1 meas.
Ki 1 meas.

Literature References

PubMed DOI Target Context # Activities
25438767 10.1016/j.bmc.2014.09.038 4-galactosyl-N-acetylglucosaminide 3-alpha-L-fucosyltransferase 9 2

Data from ChEMBL 36 via Core Engine