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Name | BDBM82254 |
---|---|
Molecular formula | C41H60N10O9S2 |
IUPAC name | (2S)-6-amino-N-[(2S)-1-[[(2R)-1-[[(2S,3R)-1-amino-3-hydroxy-1-oxobutan-2-yl]amino]-1-oxo-3-sulfanylpropan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]-2-[[(2S)-2-[[(2S)-2-[[(2R)-2-amino-3-sulfanylpropanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]hexanamide |
Molecular weight | 901.112 |
Hydrogen bond acceptor | 13 |
Hydrogen bond donor | 14 |
XlogP | 0.0 |
Synonyms | N/A |
Inchi Key | IEGUAOMABBMIGZ-AMHAHIHGSA-N |
Inchi ID | InChI=1S/C41H60N10O9S2/c1-21(2)33(41(60)49-32(20-62)40(59)51-34(22(3)52)35(44)54)50-37(56)29(10-6-7-15-42)46-39(58)31(17-24-18-45-28-9-5-4-8-26(24)28)48-38(57)30(47-36(55)27(43)19-61)16-23-11-13-25(53)14-12-23/h4-5,8-9,11-14,18,21-22,27,29-34,45,52-53,61-62H,6-7,10,15-17,19-20,42-43H2,1-3H3,(H2,44,54)(H,46,58)(H,47,55)(H,48,57)(H,49,60)(H,50,56)(H,51,59)/t22-,27+,29+,30+,31+,32+,33+,34+/m1/s1 |
PubChem CID | 57339549 |
ChEMBL | N/A |
IUPHAR | N/A |
BindingDB | 82254 |
DrugBank | N/A |
Structure | ![]() |
Lipinski's druglikeness | This ligand has more than 5 hydrogen bond donor. This ligand has more than 10 hydrogen bond acceptor. This ligand is heavier than 500 daltons. |
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GLASS ID | Name | UniProt | Gene | Species | Length |
---|---|---|---|---|---|
131134 | Somatostatin receptor type 1 | P28646 | Sstr1 | Rattus norvegicus (Rat) | 391 |
555994 | Somatostatin receptor type 2 | P30680 | Sstr2 | Rattus norvegicus (Rat) | 369 |
131133 | Somatostatin receptor type 3 | P30936 | Sstr3 | Rattus norvegicus (Rat) | 428 |
131135 | Somatostatin receptor type 4 | P30937 | Sstr4 | Rattus norvegicus (Rat) | 384 |
131136 | Somatostatin receptor type 5 | P30938 | Sstr5 | Rattus norvegicus (Rat) | 363 |
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