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Ligand

NameLanreotide acetate
Molecular formulaC54H69N11O10S2
IUPAC name10-(4-aminobutyl)-N-(1-amino-3-hydroxy-1-oxobutan-2-yl)-19-[(2-amino-3-naphthalen-2-ylpropanoyl)amino]-16-[(4-hydroxyphenyl)methyl]-13-(1H-indol-3-ylmethyl)-6,9,12,15,18-pentaoxo-7-propan-2-yl-1,2-dithia-5,8,11,14,17-pentazacycloicosane-4-carboxamide
Molecular weight1096.33
Hydrogen bond acceptor14
Hydrogen bond donor13
XlogP2.5
SynonymsLanreotide
Angiopeptin acetate
Somatuline
Somatulin
127984-74-1
[ Show all ]
Inchi KeyPUDHBTGHUJUUFI-UHFFFAOYSA-N
Inchi IDInChI=1S/C54H69N11O10S2/c1-29(2)45-54(75)63-44(53(74)65-46(30(3)66)47(57)68)28-77-76-27-43(62-48(69)38(56)23-32-15-18-33-10-4-5-11-34(33)22-32)52(73)60-41(24-31-16-19-36(67)20-17-31)50(71)61-42(25-35-26-58-39-13-7-6-12-37(35)39)51(72)59-40(49(70)64-45)14-8-9-21-55/h4-7,10-13,15-20,22,26,29-30,38,40-46,58,66-67H,8-9,14,21,23-25,27-28,55-56H2,1-3H3,(H2,57,68)(H,59,72)(H,60,73)(H,61,71)(H,62,69)(H,63,75)(H,64,70)(H,65,74)
PubChem CID71349
ChEMBLN/A
IUPHAR2031
BindingDBN/A
DrugBankDB06791

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has more than 5 hydrogen bond donor.
This ligand has more than 10 hydrogen bond acceptor.
This ligand is heavier than 500 daltons.

Known GPCRs

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Total entries: 10
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
268952Somatostatin receptor type 1P30872SSTR1Homo sapiens (Human)391
268946Somatostatin receptor type 2P30874SSTR2Homo sapiens (Human)369
554605Somatostatin receptor type 2P30875Sstr2Mus musculus (Mouse)369
554606Somatostatin receptor type 2P30680Sstr2Rattus norvegicus (Rat)369
268955Somatostatin receptor type 3P32745SSTR3Homo sapiens (Human)418
554608Somatostatin receptor type 3P30936Sstr3Rattus norvegicus (Rat)428
554609Somatostatin receptor type 3P30935Sstr3Mus musculus (Mouse)428
268953Somatostatin receptor type 4P31391SSTR4Homo sapiens (Human)388
268949Somatostatin receptor type 5P35346SSTR5Homo sapiens (Human)364
554607Somatostatin receptor type 5P30938Sstr5Rattus norvegicus (Rat)363

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