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Name | CHEMBL416286 |
---|---|
Molecular formula | C36H39N3O2 |
IUPAC name | N-benzyl-2-(3,5-dimethylphenyl)-3-[2-[4-(4-hydroxyphenyl)butylamino]ethyl]-1H-indole-5-carboxamide |
Molecular weight | 545.727 |
Hydrogen bond acceptor | 3 |
Hydrogen bond donor | 4 |
XlogP | 7.4 |
Synonyms | BDBM50101176 N-benzyl-2-(3,5-dimethylphenyl)-3-[2-[4-(4-hydroxyphenyl)butylamino]ethyl]-1H-indole-5-carboxamide 2-(3,5-Dimethyl-phenyl)-3-{2-[4-(4-hydroxy-phenyl)-butylamino]-ethyl}-1H-indole-5-carboxylic acid benzylamide |
Inchi Key | AXXZDEQUAAZLGS-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C36H39N3O2/c1-25-20-26(2)22-30(21-25)35-32(17-19-37-18-7-6-8-27-11-14-31(40)15-12-27)33-23-29(13-16-34(33)39-35)36(41)38-24-28-9-4-3-5-10-28/h3-5,9-16,20-23,37,39-40H,6-8,17-19,24H2,1-2H3,(H,38,41) |
PubChem CID | 44293343 |
ChEMBL | CHEMBL416286 |
IUPHAR | N/A |
BindingDB | 50101176 |
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 |
---|---|---|---|---|---|
17212 | Gonadotropin-releasing hormone receptor | P30969 | Gnrhr | Rattus norvegicus (Rat) | 327 |
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