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Ligand

NameCHEMBL350379
Molecular formulaC28H35N3O2S
IUPAC nameN-[2-[3-[[(3-methyl-6,7,8,9-tetrahydro-5H-benzo[7]annulen-6-yl)amino]methyl]azetidin-1-yl]ethyl]naphthalene-1-sulfonamide
Molecular weight477.667
Hydrogen bond acceptor5
Hydrogen bond donor2
XlogP4.9
SynonymsNaphthalene-1-sulfonic acid (2-{3-[(3-methyl-6,7,8,9-tetrahydro-5H-benzocyclohepten-6-ylamino)-methyl]-azetidin-1-yl}-ethyl)-amide
BDBM50110404
Inchi KeyAMQSYOMODAGIDR-UHFFFAOYSA-N
Inchi IDInChI=1S/C28H35N3O2S/c1-21-12-13-23-7-4-9-26(17-25(23)16-21)29-18-22-19-31(20-22)15-14-30-34(32,33)28-11-5-8-24-6-2-3-10-27(24)28/h2-3,5-6,8,10-13,16,22,26,29-30H,4,7,9,14-15,17-20H2,1H3
PubChem CID44377476
ChEMBLCHEMBL350379
IUPHARN/A
BindingDB50110404
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand satisfies Lipinski's rule of five.

Known GPCRs

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Total entries: 1
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GLASS IDNameUniProtGeneSpeciesLength
9163Neuropeptide Y receptor type 5Q15761NPY5RHomo sapiens (Human)445

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