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Name | SR142948A |
---|---|
Molecular formula | C39H51N5O6 |
IUPAC name | 2-[[5-(2,6-dimethoxyphenyl)-1-[4-[3-(dimethylamino)propyl-methylcarbamoyl]-2-propan-2-ylphenyl]pyrazole-3-carbonyl]amino]adamantane-2-carboxylic acid |
Molecular weight | 685.866 |
Hydrogen bond acceptor | 8 |
Hydrogen bond donor | 2 |
XlogP | 3.6 |
Synonyms | L015605 SCHEMBL7558783 ZINC3928282 2-[5-(2,6-dimethoxyphenyl)-1-[4-[N-methyl-N-(3-dimethylaminopropyl)carbamoyl]-2-isopropylphenyl]-3-pyrazolylcarbonylamino]-2-adamantanecarboxylic acid AKOS024457043 [ Show all ] |
Inchi Key | LWULHXVBLMWCHO-UHFFFAOYSA-N |
Inchi ID | InChI=1S/C39H51N5O6/c1-23(2)29-21-26(37(46)43(5)15-9-14-42(3)4)12-13-31(29)44-32(35-33(49-6)10-8-11-34(35)50-7)22-30(41-44)36(45)40-39(38(47)48)27-17-24-16-25(19-27)20-28(39)18-24/h8,10-13,21-25,27-28H,9,14-20H2,1-7H3,(H,40,45)(H,47,48) |
PubChem CID | 5311451 |
ChEMBL | CHEMBL3040381 |
IUPHAR | 1580 |
BindingDB | 85050, 50440738 |
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 |
---|---|---|---|---|---|
198396 | Neurotensin receptor type 1 | P20789 | Ntsr1 | Rattus norvegicus (Rat) | 424 |
198397 | Neurotensin receptor type 1 | P30989 | NTSR1 | Homo sapiens (Human) | 418 |
198395 | Neurotensin receptor type 2 | Q63384 | Ntsr2 | Rattus norvegicus (Rat) | 416 |
198398 | Neurotensin receptor type 2 | O95665 | NTSR2 | Homo sapiens (Human) | 410 |
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