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Compound Detail

CHEMBL174955

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CCc1ccc(-c2nc3cc(C(=O)O)ccc3n2C2CCCCC2)s1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL174955
Phase Preclinical
Structure Type MOL
InChI Key FZWSFPWJOVMPFX-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

354.5
MW (Da)
5.53
ALogP
4
HBA
1
HBD
55.1
PSA (Ų)
0.67
QED
1
Ro5 Violations
4
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C20H22N2O2S
MW 354.48
Aromatic Rings 3
Heavy Atoms 25
NP-Likeness -1.14

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