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Name | B2 bradykinin receptor |
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Species | Cavia porcellus (Guinea pig) |
Gene | BDKRB2 |
Synonym | B2R BK-2 receptor |
Disease | N/A for non-human GPCRs |
Length | 372 |
Amino acid sequence | MFNITSQVSALNATLAQGNSCLDAEWWSWLNTIQAPFLWVLFVLAVLENIFVLSVFFLHKSSCTVAEIYLGNLAVADLILAFGLPFWAITIANNFDWLFGEVLCRMVNTMIQMNMYSSICFLMLVSIDRYLALVKTMSMGRMRGVRWAKLYSLVIWGCALLLSSPMLVFRTMKDYRDEGHNVTACLIIYPSLTWQVFTNVLLNLVGFLLPLSIITFCTVQIMQVLRNNEMQKFKEIQTERRATVLVLAVLLLFVVCWLPFQIGTFLDTLRLLGFLPGCWEHVIDLITQISSYLAYSNSCLNPLVYVIVGKRFRKKSREVYHGLCRSGGCVSEPAQSENSMGTLRTSISVDRQIHKLQDWARSSSEGTPPGLL |
UniProt | O70526 |
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 | CHEMBL4111 |
IUPHAR | N/A |
DrugBank | N/A |
Name | CHEMBL298463 |
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Molecular formula | C30H27Cl2N5O4 |
IUPAC name | 4-[(E)-3-[[2-[2,4-dichloro-N-methyl-3-[(2-methylquinazolin-8-yl)oxymethyl]anilino]-2-oxoethyl]amino]-3-oxoprop-1-enyl]-N-methylbenzamide |
Molecular weight | 592.477 |
Hydrogen bond acceptor | 6 |
Hydrogen bond donor | 2 |
XlogP | 4.7 |
Synonyms | (E)-3-(4-Methylcarbamoylphenyl)-N-[2-[methyl[2,4-dichloro-3-[(2-methylquinazoline-8-yl)oxymethyl]phenyl]amino]-2-oxoethyl]acrylamide BDBM50067311 SCHEMBL7748257 4-{(E)-2-[({[2,4-Dichloro-3-(2-methyl-quinazolin-8-yloxymethyl)-phenyl]-methyl-carbamoyl}-methyl)-carbamoyl]-vinyl}-N-methyl-benzamide |
Inchi Key | FRQLTBAERTVIAL-NTEUORMPSA-N |
Inchi ID | InChI=1S/C30H27Cl2N5O4/c1-18-34-15-21-5-4-6-25(29(21)36-18)41-17-22-23(31)12-13-24(28(22)32)37(3)27(39)16-35-26(38)14-9-19-7-10-20(11-8-19)30(40)33-2/h4-15H,16-17H2,1-3H3,(H,33,40)(H,35,38)/b14-9+ |
PubChem CID | 10651074 |
ChEMBL | CHEMBL298463 |
IUPHAR | N/A |
BindingDB | 50067311 |
DrugBank | N/A |
Structure | ![]() |
Lipinski's druglikeness | This ligand is heavier than 500 daltons. |
Parameter | Value | Reference | Database source |
---|---|---|---|
IC50 | 110.0 nM | PMID15027853, PMID9767643 | BindingDB,ChEMBL |
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