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Compound Detail

CHEMBL34023

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OC[C@H]1O[C@@H](n2cnc3c2NC=NC[C@@H]3O)[C@H](O)[C@@H]1O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL34023
Phase Preclinical
Structure Type MOL
InChI Key YOOVTUPUBVHMPG-DANLAGSESA-N
0
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

284.3
MW (Da)
-2.02
ALogP
9
HBA
5
HBD
132.4
PSA (Ų)
0.42
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

Natural Product First in Class Prodrug

Extended Properties

Molecular Formula C11H16N4O5
MW 284.27
Aromatic Rings 1
Heavy Atoms 20
NP-Likeness 1.25

Activity Summary

Ki 1 meas.

Literature References

PubMed DOI Target Context # Activities
30964283 10.1021/acs.jmedchem.9b00182 Adenosine deaminase 1

Data from ChEMBL 36 via Core Engine