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Compound Detail

CHEMBL53188

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NCCOP(=O)(O)OP(=O)(O)OC[C@H]1O[C@@H](n2cnc3c(O)nc(N)nc32)[C@H](O)[C@@H]1O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL53188
Phase Preclinical
Structure Type MOL
InChI Key RGSKVYPZXKRSTN-IOSLPCCCSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

486.3
MW (Da)
-2.06
ALogP
15
HBA
7
HBD
267.9
PSA (Ų)
0.19
QED
2
Ro5 Violations
9
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C12H20N6O11P2
MW 486.27
Aromatic Rings 2
Heavy Atoms 31
NP-Likeness 1.08

Literature References

PubMed DOI Target Context # Activities
11459637 10.1016/s0960-894x(01)00282-7 4-galactosyl-N-acetylglucosaminide 3-alpha-L-fucosyltransferase FUT5 1

Data from ChEMBL 36 via Core Engine