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Compound Detail

CHEMBL5187328

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Nc1ncnc2c1c(-c1ccccc1)cn2[C@@H]1O[C@@H]2COP(=O)(O)O[C@@H]3[C@H](O)[C@@H](COP(=O)(O)O[C@H]2[C@H]1O)O[C@H]3n1cc(-c2ccccc2)c2c(N)ncnc21
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL5187328
Phase Preclinical
Structure Type MOL
InChI Key SHKICKMBMVUYJV-NJVYLJTFSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

808.6
MW (Da)
2.91
ALogP
18
HBA
6
HBD
283.9
PSA (Ų)
0.14
QED
3
Ro5 Violations
4
Rot. Bonds

Drug Information

Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C34H34N8O12P2
MW 808.64
Aromatic Rings 6
Heavy Atoms 56
NP-Likeness 0.44

Literature References

PubMed DOI Target Context # Activities
36201304 10.1021/acs.jmedchem.2c01305 Unchecked 4
36201304 10.1021/acs.jmedchem.2c01305 Stimulator of interferon genes protein 3

Data from ChEMBL 36 via Core Engine