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Compound Detail

CHEMBL3144267

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N=c1ccn([C@H]2C[C@H](O)[C@@H](CO)O2)c(=O)n1N
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3144267
Phase Preclinical
Structure Type MOL
InChI Key UMYWOMMIFUJHCC-SHYZEUOFSA-N
0
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

242.2
MW (Da)
-2.52
ALogP
8
HBA
4
HBD
126.5
PSA (Ų)
0.43
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 C9H14N4O4
MW 242.24
Aromatic Rings 1
Heavy Atoms 17
NP-Likeness 0.95

Activity Summary

IC50 1 meas.

Literature References

PubMed DOI Target Context # Activities
6538600 10.1021/jm00370a006 L1210 2

Data from ChEMBL 36 via Core Engine