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Ligand

NameSCHEMBL3777493
Molecular formulaC27H29N5O2
IUPAC nameN-(1-pyridin-2-ylethyl)-7-[4-(2-pyridin-2-ylethyl)piperazin-1-yl]-1-benzofuran-2-carboxamide
Molecular weight455.562
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP3.7
SynonymsN-(1-(Pyridin-2-yl)ethyl)-7-(4-(2-(pyridin-2-yl)ethyl)piperazin-1-yl)benzofuran-2-carboxamide
ZMQQTGKVVFPDSJ-UHFFFAOYSA-N
CHEMBL3647265
US8859534, 7
BDBM136321
Inchi KeyZMQQTGKVVFPDSJ-UHFFFAOYSA-N
Inchi IDInChI=1S/C27H29N5O2/c1-20(23-9-3-5-13-29-23)30-27(33)25-19-21-7-6-10-24(26(21)34-25)32-17-15-31(16-18-32)14-11-22-8-2-4-12-28-22/h2-10,12-13,19-20H,11,14-18H2,1H3,(H,30,33)
PubChem CID59636704
ChEMBLCHEMBL3647265
IUPHARN/A
BindingDB136321
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
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
5337115-hydroxytryptamine receptor 1BP46636HTR1BCricetulus griseus (Chinese hamster)386

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