VELNEPERIT

/static/temp/default.svg Search structure
Synonyms
Status
Molecule Category Free-form
UNII 09BQ2KJ22J

Structure

InChI Key WGEWUYACXPEFPO-AULYBMBSSA-N
Smiles CC(C)(C)S(=O)(=O)N[C@H]1CC[C@H](C(=O)Nc2ccc(C(F)(F)F)cn2)CC1
InChI
InChI=1S/C17H24F3N3O3S/c1-16(2,3)27(25,26)23-13-7-4-11(5-8-13)15(24)22-14-9-6-12(10-21-14)17(18,19)20/h6,9-11,13,23H,4-5,7-8H2,1-3H3,(H,21,22,24)/t11-,13-

Physicochemical Descriptors

Property Name Value
Molecular Formula C17H24F3N3O3S
Molecular Weight 407.46
AlogP 3.32
Hydrogen Bond Acceptor 4.0
Hydrogen Bond Donor 2.0
Number of Rotational Bond 4.0
Polar Surface Area 88.16
Molecular species NEUTRAL
Aromatic Rings 1.0
Heavy Atoms 27.0

Pharmacology

Mechanism of Action Action Reference
Neuropeptide Y receptor type 5 antagonist ANTAGONIST PubMed
Targets EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Membrane receptor Family A G protein-coupled receptor Peptide receptor (family A GPCR) Short peptide receptor (family A GPCR) Neuropeptide Y receptor
- 4.6-4.6 - 5 -
EC50(nM) IC50(nM) Kd(nM) Ki(nM) Inhibition(%)
Homo sapiens
- - - 5 -
Mus musculus
- 4.6-4.6 - - -

Target Conservation

Protein: Neuropeptide Y receptor type 5
Description: Neuropeptide Y receptor type 5
Organism : Homo sapiens
Q15761 ENSG00000164129

Cross References

Resources Reference
ChEMBL CHEMBL2016681
DrugBank DB12889
FDA SRS 09BQ2KJ22J
PubChem 20629114
SureChEMBL SCHEMBL2806595
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