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Ligand

NameCHEMBL100162
Molecular formulaC26H26N2OS2
IUPAC nameN-(2-benzylsulfanylphenyl)-N-[3-(methylamino)propyl]-1-benzothiophene-2-carboxamide
Molecular weight446.627
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP6.2
SynonymsN-[3-(Methylamino)propyl]-N-[2-(benzylthio)phenyl]benzo[b]thiophene-2-carboxamide
BDBM50135648
Benzo[b]thiophene-2-carboxylic acid (2-benzylsulfanyl-phenyl)-(3-methylamino-propyl)-amide
Inchi KeyADUPCOZSFKRFSY-UHFFFAOYSA-N
Inchi IDInChI=1S/C26H26N2OS2/c1-27-16-9-17-28(26(29)25-18-21-12-5-7-14-23(21)31-25)22-13-6-8-15-24(22)30-19-20-10-3-2-4-11-20/h2-8,10-15,18,27H,9,16-17,19H2,1H3
PubChem CID44329420
ChEMBLCHEMBL100162
IUPHARN/A
BindingDB50135648
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
3108Neuropeptide Y receptor type 2P49146NPY2RHomo sapiens (Human)381

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