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Name | CHEMBL417726 |
---|---|
Molecular formula | C32H38N4O2 |
IUPAC name | [2-(3,5-dimethylphenyl)-3-[2-(4-pyridin-3-ylbutylamino)ethyl]-1H-indol-5-yl]-morpholin-4-ylmethanone |
Molecular weight | 510.682 |
Hydrogen bond acceptor | 4 |
Hydrogen bond donor | 2 |
XlogP | 5.0 |
Synonyms | BDBM50101238 {2-(3,5-Dimethyl-phenyl)-3-[2-(4-pyridin-3-yl-butylamino)-ethyl]-1H-indol-5-yl}-morpholin-4-yl-methanone 2-(3,5-Dimethylphenyl)-3-[2-[4-(3-pyridinyl)butylamino]ethyl]-5-(morpholinocarbonyl)-1H-indole |
Inchi Key | AXMCBKVTDXJSIS-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C32H38N4O2/c1-23-18-24(2)20-27(19-23)31-28(10-13-33-11-4-3-6-25-7-5-12-34-22-25)29-21-26(8-9-30(29)35-31)32(37)36-14-16-38-17-15-36/h5,7-9,12,18-22,33,35H,3-4,6,10-11,13-17H2,1-2H3 |
PubChem CID | 44293651 |
ChEMBL | CHEMBL417726 |
IUPHAR | N/A |
BindingDB | 50101238 |
DrugBank | N/A |
Structure | |
Lipinski's druglikeness | This ligand is heavier than 500 daltons. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
16845 | Gonadotropin-releasing hormone receptor | P30969 | Gnrhr | Rattus norvegicus (Rat) | 327 |
zhanglabzhanggroup.org | (734) 647-1549 | 100 Washtenaw Avenue, Ann Arbor, MI 48109-2218