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Compound Detail

CHEMBL1083324

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CN(C(=O)C1(c2ccc(Cl)cc2)CCCCC1)c1ccccc1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL1083324
Phase Preclinical
Structure Type MOL
InChI Key BKHWOWXMPNRNDP-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

327.9
MW (Da)
5.20
ALogP
1
HBA
0
HBD
20.3
PSA (Ų)
0.76
QED
1
Ro5 Violations
3
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C20H22ClNO
MW 327.86
Aromatic Rings 2
Heavy Atoms 23
NP-Likeness -1.06

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