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Name | CHEMBL252255 |
---|---|
Molecular formula | C36H33N7O3 |
IUPAC name | pyridin-2-yl N-[(1R)-2-(1H-indol-3-yl)-1-[5-[2-(1H-indol-3-yl)ethyl]-4-[(4-methoxyphenyl)methyl]-1,2,4-triazol-3-yl]ethyl]carbamate |
Molecular weight | 611.706 |
Hydrogen bond acceptor | 6 |
Hydrogen bond donor | 3 |
XlogP | 5.9 |
Synonyms | BDBM50227177 (R)-pyridin-2-yl 1-(5-(2-(1H-indol-3-yl)ethyl)-4-(4-methoxybenzyl)-4H-1,2,4-triazol-3-yl)-2-(1H-indol-3-yl)ethylcarbamate |
Inchi Key | AMJHEXHBMBEBSJ-JGCGQSQUSA-N |
Inchi ID | InChI=1S/C36H33N7O3/c1-45-27-16-13-24(14-17-27)23-43-33(18-15-25-21-38-30-10-4-2-8-28(25)30)41-42-35(43)32(40-36(44)46-34-12-6-7-19-37-34)20-26-22-39-31-11-5-3-9-29(26)31/h2-14,16-17,19,21-22,32,38-39H,15,18,20,23H2,1H3,(H,40,44)/t32-/m1/s1 |
PubChem CID | 44446187 |
ChEMBL | CHEMBL252255 |
IUPHAR | N/A |
BindingDB | 50227177 |
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 |
---|---|---|---|---|---|
8941 | Growth hormone secretagogue receptor type 1 | Q92847 | GHSR | Homo sapiens (Human) | 366 |
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