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Compound Detail

CHEMBL102768

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Cc1cn([C@@H]2O[C@H](C)[C@@H](N)[C@H]2O)c(=O)[nH]c1=O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL102768
Phase Preclinical
Structure Type MOL
InChI Key GACITEXDWPETTF-JXOAFFINSA-N
0
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

241.2
MW (Da)
-1.55
ALogP
6
HBA
3
HBD
110.3
PSA (Ų)
0.55
QED
0
Ro5 Violations
1
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C10H15N3O4
MW 241.25
Aromatic Rings 1
Heavy Atoms 17
NP-Likeness 0.74

Activity Summary

Ki 1 meas.

Literature References

PubMed DOI Target Context # Activities
12941330 10.1016/s0960-894x(03)00643-7 Thymidylate kinase 1

Data from ChEMBL 36 via Core Engine