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Name | B1 bradykinin receptor |
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Species | Macaca fascicularis (Crab-eating macaque) |
Gene | BDKRB1 |
Synonym | B1R BK-1 receptor |
Disease | N/A for non-human GPCRs |
Length | 352 |
Amino acid sequence | MASWPPLQLQSSNQSQLFPQNATACDNAPEAWDLLHRVLPTFIISICSFGLLGNLFVLLVFLLPRRRLNVAEIYLANLAASDLVFVLGLPFWAENIWNQFNWPFGALLCRVINGIIKANLFISIFLVVAISQDRYCVLVHPMASRRRQRRRQARVTCVLIWVVGGLLSIPTFLLRSIQAVPDLNITACILLLPHEAWHFARIVELNILAFLLPLAAIIFFNYHILASLRGREEVSRTRCGGSKDSKTTALILTLVVAFLVCWAPYHFFAFLEFLFQVQAVRGCFWEDFIDLGLQLANFLAFTNSSLNPVIYVFAGRLFRTKVWELYKQCTPKSLAPISSSHRKEIFQLFWRN |
UniProt | Q3BCU0 |
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 | CHEMBL5155 |
IUPHAR | N/A |
DrugBank | N/A |
Name | CHEMBL522789 |
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Molecular formula | C29H26N6O2 |
IUPAC name | 1-benzyl-N-[2-[methyl-[(4-pyrimidin-2-ylphenyl)methyl]amino]-2-oxoethyl]benzimidazole-2-carboxamide |
Molecular weight | 490.567 |
Hydrogen bond acceptor | 5 |
Hydrogen bond donor | 1 |
XlogP | 3.6 |
Synonyms | BDBM50264631 N-(2-((4-(pyrimidin-2-yl)benzyl)(methyl)amino)-2-oxoethyl)-1-benzyl-1H-benzo[d]imidazole-2-carboxamide |
Inchi Key | ZYOUDYPMRFJNRP-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C29H26N6O2/c1-34(19-22-12-14-23(15-13-22)27-30-16-7-17-31-27)26(36)18-32-29(37)28-33-24-10-5-6-11-25(24)35(28)20-21-8-3-2-4-9-21/h2-17H,18-20H2,1H3,(H,32,37) |
PubChem CID | 44579968 |
ChEMBL | CHEMBL522789 |
IUPHAR | N/A |
BindingDB | 50264631 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand satisfies Lipinski's rule of five. |
Parameter | Value | Reference | Database source |
---|---|---|---|
IC50 | 330.0 nM | PMID18752949 | BindingDB,ChEMBL |
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