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Name | CHEMBL26332 |
---|---|
Molecular formula | C31H30F3N3O5S |
IUPAC name | 3-[[2-methoxy-4-[(2-methylphenyl)sulfonylcarbamoyl]phenyl]methyl]-1-methyl-N-(4,4,4-trifluoro-2-methylidenebutyl)indole-5-carboxamide |
Molecular weight | 613.652 |
Hydrogen bond acceptor | 8 |
Hydrogen bond donor | 2 |
XlogP | 6.2 |
Synonyms | 1-Methyl-3-[2-methoxy-4-[[(2-methylphenyl)sulfonyl]carbamoyl]benzyl]-N-[2-(2,2,2-trifluoroethyl)-2-propenyl]-1H-indole-5-carboxamide BDBM50041345 3-[2-Methoxy-4-(toluene-2-sulfonylaminocarbonyl)-benzyl]-1-methyl-1H-indole-5-carboxylic acid (4,4,4-trifluoro-2-methylene-butyl)-amide |
Inchi Key | CITRUMWMTDCXJN-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C31H30F3N3O5S/c1-19(16-31(32,33)34)17-35-29(38)22-11-12-26-25(14-22)24(18-37(26)3)13-21-9-10-23(15-27(21)42-4)30(39)36-43(40,41)28-8-6-5-7-20(28)2/h5-12,14-15,18H,1,13,16-17H2,2-4H3,(H,35,38)(H,36,39) |
PubChem CID | 10348808 |
ChEMBL | CHEMBL26332 |
IUPHAR | N/A |
BindingDB | 50041345 |
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 |
---|---|---|---|---|---|
42955 | Cysteinyl leukotriene receptor 1 | Q2NNR5 | CYSLTR1 | Cavia porcellus (Guinea pig) | 340 |
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