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Ligand

NameCHEMBL164586
Molecular formulaC29H38N4O2S
IUPAC nameN-[2-[4-[[(3-amino-6,7,8,9-tetrahydro-5H-benzo[7]annulen-6-yl)amino]methyl]piperidin-1-yl]ethyl]naphthalene-1-sulfonamide
Molecular weight506.709
Hydrogen bond acceptor6
Hydrogen bond donor3
XlogP4.6
SynonymsBDBM50110414
Naphthalene-1-sulfonic acid (2-{4-[(3-amino-6,7,8,9-tetrahydro-5H-benzocyclohepten-6-ylamino)-methyl]-piperidin-1-yl}-ethyl)-amide
Inchi KeyBBZYLZUPRQGZEQ-UHFFFAOYSA-N
Inchi IDInChI=1S/C29H38N4O2S/c30-26-12-11-23-6-3-8-27(20-25(23)19-26)31-21-22-13-16-33(17-14-22)18-15-32-36(34,35)29-10-4-7-24-5-1-2-9-28(24)29/h1-2,4-5,7,9-12,19,22,27,31-32H,3,6,8,13-18,20-21,30H2
PubChem CID44377691
ChEMBLCHEMBL164586
IUPHARN/A
BindingDB50110414
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
19999Neuropeptide Y receptor type 5Q15761NPY5RHomo sapiens (Human)445

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