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Ligand

NameCHEMBL1078863
Molecular formulaC27H37N3O3S
IUPAC nameN-[3-(1-acetylpiperidin-4-yl)-1,2,4,5-tetrahydro-3-benzazepin-7-yl]-4-butylbenzenesulfonamide
Molecular weight483.671
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP4.7
SynonymsBDBM50415692
Inchi KeyBNGJUFOQKFIMHD-UHFFFAOYSA-N
Inchi IDInChI=1S/C27H37N3O3S/c1-3-4-5-22-6-10-27(11-7-22)34(32,33)28-25-9-8-23-12-16-30(17-13-24(23)20-25)26-14-18-29(19-15-26)21(2)31/h6-11,20,26,28H,3-5,12-19H2,1-2H3
PubChem CID46882347
ChEMBLCHEMBL1078863
IUPHARN/A
BindingDB50415692
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
28094Motilin receptorO43193MLNRHomo sapiens (Human)412

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