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Compound Detail

CHEMBL278733

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O=c1[nH][nH]c(=O)c2c(O)c3sccc3nc12

Basic Information

ChEMBL ID CHEMBL278733
Phase Preclinical
Structure Type MOL
InChI Key RGYZJVTVTALEJJ-UHFFFAOYSA-N
1
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

235.2
MW (Da)
0.53
ALogP
5
HBA
3
HBD
98.8
PSA (Ų)
0.53
QED
0
Ro5 Violations
0
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C9H5N3O3S
MW 235.22
Aromatic Rings 3
Heavy Atoms 16
NP-Likeness -1.04

Activity Summary

Ki 1 meas. best 5.3

Target Activity Profile

Target Type Best pChEMBL Mean pChEMBL Best (nM) # Data
Queuine tRNA-ribosyltransferase
CHEMBL2987
Ki 5.3 5.3 5000.0 1

Activity Data Samples

Top measurements by pChEMBL value

Literature References

PubMed DOI Target Context # Activities
12646024 10.1021/jm0209937 Queuine tRNA-ribosyltransferase 1

Data from ChEMBL 36 via Core Engine