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Compound Detail

CHEMBL271218

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CCCCCCCC/C=C\CCCCCCCC(=O)c1nc2ccccc2s1
ChEMBL ↗ Properties Compare Identifier

Basic Information

ChEMBL ID CHEMBL271218
Phase Preclinical
Structure Type MOL
InChI Key NFGFRKUBOHJQQY-KTKRTIGZSA-N
0
Targets
0
Activities
0
Assay Types
0
PK Parameters
1
Publications
0
Known Names

Molecular Properties

399.6
MW (Da)
8.52
ALogP
3
HBA
0
HBD
30.0
PSA (Ų)
0.16
QED
1
Ro5 Violations
16
Rot. Bonds

Drug Information

Molecule Type Small molecule
Availability Unknown
Chirality Unknown

Flags

First in Class Prodrug

Extended Properties

Molecular Formula C25H37NOS
MW 399.64
Aromatic Rings 2
Heavy Atoms 28
NP-Likeness -0.27

Literature References

PubMed DOI Target Context # Activities
18053726 10.1016/j.bmc.2007.11.015 Fatty-acid amide hydrolase 1 1

Data from ChEMBL 36 via Core Engine