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Compound Detail

CHEMBL1084487

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O=C(Nc1ccccc1)C1(c2ccccc2)CCCC1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1084487
Phase Preclinical
Structure Type MOL
InChI Key QOVNFHDQKWMOHW-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

265.4
MW (Da)
4.14
ALogP
1
HBA
1
HBD
29.1
PSA (Ų)
0.89
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 C18H19NO
MW 265.36
Aromatic Rings 2
Heavy Atoms 20
NP-Likeness -0.96

Literature References

PubMed DOI Target Context # Activities
20494579 10.1016/j.bmcl.2010.04.141 Influenza A virus (A/Puerto Rico/8/1934(H1N1)) 1
20494579 10.1016/j.bmcl.2010.04.141 MDCK 1

Data from ChEMBL 36 via Core Engine