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Compound Detail

CHEMBL3403302

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O=C(Nc1ccc2oc(C3CCCCC3)c(CO)c(=O)c2c1)C1CCCCC1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL3403302
Phase Preclinical
Structure Type MOL
InChI Key HFXPBQSTAWQKDH-UHFFFAOYSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

383.5
MW (Da)
4.85
ALogP
4
HBA
2
HBD
79.5
PSA (Ų)
0.79
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 C23H29NO4
MW 383.49
Aromatic Rings 2
Heavy Atoms 28
NP-Likeness -0.45

Literature References

PubMed DOI Target Context # Activities
25865130 10.1016/j.bmc.2015.03.045 Interleukin-5 2

Data from ChEMBL 36 via Core Engine