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Compound Detail

CHEMBL167208

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Cc1ccc(C(=O)CCCCOc2ccc(C(=O)NCCO)cc2)o1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL167208
Phase Preclinical
Structure Type MOL
InChI Key FESAPXZBROKAGI-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
2
Publications
0
Known Names

Molecular Properties

345.4
MW (Da)
2.74
ALogP
5
HBA
2
HBD
88.8
PSA (Ų)
0.51
QED
0
Ro5 Violations
10
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C19H23NO5
MW 345.40
Aromatic Rings 2
Heavy Atoms 25
NP-Likeness -0.82

Literature References

PubMed DOI Target Context # Activities
7877145 10.1021/jm00005a007 HeLa 2
7877145 10.1021/jm00005a007 Human rhinovirus sp. 2

Data from ChEMBL 36 via Core Engine