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Compound Detail

CHEMBL4293107

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CCCCCCCCCCCCC/C(=N\O)c1cc(-c2ccc(OC)c(F)c2)ccc1O
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL4293107
Phase Preclinical
Structure Type MOL
InChI Key QPZBXTBMCZMGAR-XLVZBRSZSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

443.6
MW (Da)
8.09
ALogP
4
HBA
2
HBD
62.0
PSA (Ų)
0.13
QED
1
Ro5 Violations
15
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C27H38FNO3
MW 443.60
Aromatic Rings 2
Heavy Atoms 32
NP-Likeness -0.28

Literature References

PubMed DOI Target Context # Activities
30144699 10.1016/j.ejmech.2018.08.038 Monoglyceride lipase 1

Data from ChEMBL 36 via Core Engine