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Ligand

NameBDBM84629
Molecular formulaC71H81N11O9
IUPAC name(2S)-6-amino-N-[(2S)-1-[[(2S)-1-[[(2R)-1-amino-3-naphthalen-1-yl-1-oxopropan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]-2-[[(2R)-2-[[(2S)-2-[[(2S)-2-[[(2R)-2-amino-3-phenylpropanoyl]amino]-3-phenylpropanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]hexanamide
Molecular weight1232.5
Hydrogen bond acceptor11
Hydrogen bond donor12
XlogP8.1
SynonymsN/A
Inchi KeyAWRMNKFDOAUSCG-OOSWLFMASA-N
Inchi IDInChI=1S/C71H81N11O9/c1-44(2)63(71(91)81-61(39-47-23-10-5-11-24-47)67(87)77-58(64(74)84)41-50-27-18-26-49-25-12-13-28-53(49)50)82-66(86)57(31-16-17-36-72)76-70(90)62(42-51-43-75-56-30-15-14-29-54(51)56)80-69(89)60(40-48-32-34-52(83)35-33-48)79-68(88)59(38-46-21-8-4-9-22-46)78-65(85)55(73)37-45-19-6-3-7-20-45/h3-15,18-30,32-35,43-44,55,57-63,75,83H,16-17,31,36-42,72-73H2,1-2H3,(H2,74,84)(H,76,90)(H,77,87)(H,78,85)(H,79,88)(H,80,89)(H,81,91)(H,82,86)/t55-,57+,58-,59+,60+,61+,62-,63+/m1/s1
PubChem CID91898903
ChEMBLN/A
IUPHARN/A
BindingDB84629
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.
This ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 12
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
16294Somatostatin receptor type 1P28646Sstr1Rattus norvegicus (Rat)391
16298Somatostatin receptor type 1P30872SSTR1Homo sapiens (Human)391
555546Somatostatin receptor type 2P30874SSTR2Homo sapiens (Human)369
555547Somatostatin receptor type 2P30680Sstr2Rattus norvegicus (Rat)369
555548Somatostatin receptor type 2P30875Sstr2Mus musculus (Mouse)369
16295Somatostatin receptor type 3P30936Sstr3Rattus norvegicus (Rat)428
16297Somatostatin receptor type 3P32745SSTR3Homo sapiens (Human)418
16299Somatostatin receptor type 3P30935Sstr3Mus musculus (Mouse)428
16293Somatostatin receptor type 4P31391SSTR4Homo sapiens (Human)388
16300Somatostatin receptor type 4P30937Sstr4Rattus norvegicus (Rat)384
16292Somatostatin receptor type 5P35346SSTR5Homo sapiens (Human)364
16296Somatostatin receptor type 5P30938Sstr5Rattus norvegicus (Rat)363

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