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Ligand

NameBDBM82254
Molecular formulaC41H60N10O9S2
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 weight901.112
Hydrogen bond acceptor13
Hydrogen bond donor14
XlogP0.0
SynonymsN/A
Inchi KeyIEGUAOMABBMIGZ-AMHAHIHGSA-N
Inchi IDInChI=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 CID57339549
ChEMBLN/A
IUPHARN/A
BindingDB82254
DrugBankN/A

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: 5
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
131134Somatostatin receptor type 1P28646Sstr1Rattus norvegicus (Rat)391
555994Somatostatin receptor type 2P30680Sstr2Rattus norvegicus (Rat)369
131133Somatostatin receptor type 3P30936Sstr3Rattus norvegicus (Rat)428
131135Somatostatin receptor type 4P30937Sstr4Rattus norvegicus (Rat)384
131136Somatostatin receptor type 5P30938Sstr5Rattus norvegicus (Rat)363

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