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GLASS

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Go to the GPCR, ligand, or experimental data tables.
Go to the experimental data table for text mining information in PubMed ID column.
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GPCR

Name	5-hydroxytryptamine receptor 1B
Species	Cricetulus griseus (Chinese hamster)
Gene	HTR1B
Synonym	5-HT-1B 5-HT1B Serotonin receptor 1B
Disease	N/A for non-human GPCRs
Length	386
Amino acid sequence	MEEQGIQCAPPPPAASQTGVPLVNLSHNCSAESHIYQDSIALPWKVLLVALLALITLATTLSNAFVIATVYRTRKLHTPANYLIASLAVTDLLVSILVMPVSTMYTVTGRWTLGQVVCDFWLSSDITCCTASIMHLCVIALDRYWAITDAVEYAAKRTPKRAAIMIALVWVFSISISLPPFFWRQAKAEEEVLTCLVNTDHVLYTVYSTGGAFYLPTLLLIALYGRIYVEARSRILKQTPNKTGKRLTRAQLITDSPGSTTSVTSINSRAPDLPSESGSPVYVNQVKVRVSDALLEKKKLMAARERKATKTLGIILGAFIVCWLPFFIISLVMPICKDACWFHMATLDFFNWLGYLNSLINPIIYTMSNEDFKQAFHKLIRFKCAG
UniProt	P46636
Protein Data Bank	N/A
GPCR-HGmod model	N/A
3D structure model	No available structures or models
BioLiP	N/A
Therapeutic Target Database	N/A
ChEMBL	CHEMBL3707466
IUPHAR	N/A
DrugBank	N/A

Ligand

Name	SCHEMBL931928
Molecular formula	C23H25N5O2
IUPAC name	7-[4-[2-(4-cyanopyridin-2-yl)ethyl]piperazin-1-yl]-N,N-dimethyl-1-benzofuran-2-carboxamide
Molecular weight	403.486
Hydrogen bond acceptor	6
Hydrogen bond donor	0
XlogP	2.7
Synonyms	BDBM136355 FVKDRXNFIUNQBF-UHFFFAOYSA-N 7-(4-(2-(4-Cyanopyridin-2-yl)ethyl)piperazin-1-yl)-N,N-dimethylbenzofuran-2-carboxamide CHEMBL3650034 US8859534, 41
Inchi Key	FVKDRXNFIUNQBF-UHFFFAOYSA-N
Inchi ID	InChI=1S/C23H25N5O2/c1-26(2)23(29)21-15-18-4-3-5-20(22(18)30-21)28-12-10-27(11-13-28)9-7-19-14-17(16-24)6-8-25-19/h3-6,8,14-15H,7,9-13H2,1-2H3
PubChem CID	66847540
ChEMBL	CHEMBL3650034
IUPHAR	N/A
BindingDB	136355
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Experimental Data

Parameter	Value	Reference	Database source
Ki	73.0 nM	, None	BindingDB,ChEMBL

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