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Name | CHEMBL23418 |
---|---|
Molecular formula | C30H30N2O7S |
IUPAC name | methyl 3-[1-(1,3-benzodioxol-5-yl)-2-oxo-2-[(4-propan-2-ylphenyl)sulfonylamino]ethyl]-1-ethylindole-6-carboxylate |
Molecular weight | 562.637 |
Hydrogen bond acceptor | 7 |
Hydrogen bond donor | 1 |
XlogP | 5.1 |
Synonyms | 1-Ethyl-3-[1-(1,3-benzodioxole-5-yl)-2-oxo-2-(4-isopropylphenylsulfonylamino)ethyl]-1H-indole-6-carboxylic acid methyl ester BDBM50108186 3-[1-Benzo[1,3]dioxol-5-yl-2-(4-isopropyl-benzenesulfonylamino)-2-oxo-ethyl]-1-ethyl-1H-indole-6-carboxylic acid methyl ester |
Inchi Key | AXDHCWCWSPYZIW-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C30H30N2O7S/c1-5-32-16-24(23-12-8-21(14-25(23)32)30(34)37-4)28(20-9-13-26-27(15-20)39-17-38-26)29(33)31-40(35,36)22-10-6-19(7-11-22)18(2)3/h6-16,18,28H,5,17H2,1-4H3,(H,31,33) |
PubChem CID | 18738889 |
ChEMBL | CHEMBL23418 |
IUPHAR | N/A |
BindingDB | 50108186 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand is heavier than 500 daltons. This ligand has a partition coefficient log P greater than 5. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
16568 | Endothelin-1 receptor | P25101 | EDNRA | Homo sapiens (Human) | 427 |
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