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Name | 5-hydroxytryptamine receptor 1B |
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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 |
Name | SCHEMBL932393 |
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Molecular formula | C27H31FN4O3 |
IUPAC name | 7-[4-[2-(1-acetyl-2,3-dihydroindol-5-yl)ethyl]piperazin-1-yl]-5-fluoro-N,N-dimethyl-1-benzofuran-2-carboxamide |
Molecular weight | 478.568 |
Hydrogen bond acceptor | 6 |
Hydrogen bond donor | 0 |
XlogP | 3.5 |
Synonyms | CHEMBL3650044 BOJKVAPAYVHEQV-UHFFFAOYSA-N 7-(4-(2-(1-Acetylindolin-5-yl)ethyl)piperazin-1-yl)-5-fluoro-N,N-dimethylbenzofuran-2-carboxamide US8859534, 51 BDBM136365 |
Inchi Key | BOJKVAPAYVHEQV-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C27H31FN4O3/c1-18(33)32-9-7-20-14-19(4-5-23(20)32)6-8-30-10-12-31(13-11-30)24-17-22(28)15-21-16-25(35-26(21)24)27(34)29(2)3/h4-5,14-17H,6-13H2,1-3H3 |
PubChem CID | 59636778 |
ChEMBL | CHEMBL3650044 |
IUPHAR | N/A |
BindingDB | 136365 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand satisfies Lipinski's rule of five. |
Parameter | Value | Reference | Database source |
---|---|---|---|
Ki | 5.0 nM | , None | BindingDB,ChEMBL |
zhanglabzhanggroup.org | +65-6601-1241 | Computing 1, 13 Computing Drive, Singapore 117417