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Compound Detail

CHEMBL103880

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Basic Information

ChEMBL ID CHEMBL103880
Phase Preclinical
Structure Type MOL
InChI Key TVQLXMVGEZHTMA-UHFFFAOYSA-N
0
Targets
1
Activities
1
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

158.3
MW (Da)
1.51
ALogP
2
HBA
2
HBD
38.0
PSA (Ų)
0.53
QED
0
Ro5 Violations
8
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C9H22N2
MW 158.29
Aromatic Rings 0
Heavy Atoms 11
NP-Likeness 0.24

Activity Summary

IC50 1 meas.

Literature References

PubMed DOI Target Context # Activities
7636868 10.1021/jm00016a008 Deoxyhypusine synthase 1
7636868 10.1021/jm00016a008 CHO 1

Data from ChEMBL 36 via Core Engine