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Compound Detail

CHEMBL175454

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O=C(O)c1ccc2c(c1)nc(-c1ccccn1)n2-c1ccccc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL175454
Phase Preclinical
Structure Type MOL
InChI Key PJSCHRRNEKWZPW-UHFFFAOYSA-N
0
Targets
1
Activities
1
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

315.3
MW (Da)
3.79
ALogP
4
HBA
1
HBD
68.0
PSA (Ų)
0.62
QED
0
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C19H13N3O2
MW 315.33
Aromatic Rings 4
Heavy Atoms 24
NP-Likeness -1.23

Activity Summary

IC50 1 meas.

Literature References

PubMed DOI Target Context # Activities
14684311 10.1016/j.bmcl.2003.10.023 RNA-directed RNA polymerase 1

Data from ChEMBL 36 via Core Engine