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Compound Detail

CHEMBL1651378

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OC[C@H]1O[C@@H](n2cnc3c2N=CN=C[C@@H]3O)C[C@@H]1O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1651378
Phase Preclinical
Structure Type MOL
InChI Key RTSRXQQKWGEUQK-RBXMUDONSA-N
0
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

266.3
MW (Da)
-0.70
ALogP
8
HBA
3
HBD
112.5
PSA (Ų)
0.65
QED
0
Ro5 Violations
2
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C11H14N4O4
MW 266.26
Aromatic Rings 1
Heavy Atoms 19
NP-Likeness 1.15

Activity Summary

Ki 1 meas.

Literature References

PubMed DOI Target Context # Activities
21138280 10.1021/jm101286g Adenosine deaminase 1

Data from ChEMBL 36 via Core Engine