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Name | Type-1 angiotensin II receptor |
---|---|
Species | Bos taurus (Bovine) |
Gene | AGTR1 |
Synonym | Angiotensin II type-1 receptor AT1 |
Disease | N/A for non-human GPCRs |
Length | 359 |
Amino acid sequence | MILNSSTEDGIKRIQDDCPKAGRHNYIFIMIPTLYSIIFVVGIFGNSLVVIVIYFYMKLKTVASVFLLNLALADLCFLLTLPLWAVYTAMEYRWPFGNYLCKIASASVSFNLYASVFLLTCLSIDRYLAIVHPMKSRLRRTMLVAKVTCIIIWLLAGLASLPTIIHRNVFFIENTNITVCAFHYESQNSTLPVGLGLTKNILGFLFPFLIILTSYTLIWKTLKKAYEIQKNKPRKDDIFKIILAIVLFFFFSWVPHQIFTFMDVLIQLGLIRDCKIEDIVDTAMPITICLAYFNNCLNPLFYGFLGKKFKKYFLQLLKYIPPKAKSHSNLSTKMSTLSYRPSENGNSSTKKPAPCIEVE |
UniProt | P25104 |
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 | CHEMBL3374 |
IUPHAR | N/A |
DrugBank | N/A |
Name | CHEMBL306670 |
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Molecular formula | C18H18N4O5 |
IUPAC name | 4-[(2-butylbenzimidazol-1-yl)methyl]-2,6-dinitrophenol |
Molecular weight | 370.365 |
Hydrogen bond acceptor | 6 |
Hydrogen bond donor | 1 |
XlogP | 4.6 |
Synonyms | 4-(2-Butyl-benzoimidazol-1-ylmethyl)-2,6-dinitro-phenol BDBM50282352 |
Inchi Key | DJWBQMJYLVKFQE-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C18H18N4O5/c1-2-3-8-17-19-13-6-4-5-7-14(13)20(17)11-12-9-15(21(24)25)18(23)16(10-12)22(26)27/h4-7,9-10,23H,2-3,8,11H2,1H3 |
PubChem CID | 44309040 |
ChEMBL | CHEMBL306670 |
IUPHAR | N/A |
BindingDB | 50282352 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand satisfies Lipinski's rule of five. |
Parameter | Value | Reference | Database source |
---|---|---|---|
IC50 | 1600.0 nM | , Bioorg. Med. Chem. Lett., (1994) 4:1:213 | BindingDB,ChEMBL |
zhanglabzhanggroup.org | +65-6601-1241 | Computing 1, 13 Computing Drive, Singapore 117417