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Compound Detail

CHEMBL178045

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O=C(O)c1ccc2c(c1)nc(-c1ccc(CO)o1)n2C1CCCCC1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL178045
Phase Preclinical
Structure Type MOL
InChI Key PCNSQMSHCZZTCX-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

340.4
MW (Da)
3.99
ALogP
5
HBA
2
HBD
88.5
PSA (Ų)
0.75
QED
0
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C19H20N2O4
MW 340.38
Aromatic Rings 3
Heavy Atoms 25
NP-Likeness -0.69

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