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Ligand

NameCHEMBL466609
Molecular formulaC34H39N5O3
IUPAC name(2S)-6-amino-2-[(4R)-3-oxo-4-[(2-phenylacetyl)amino]-1,4,5,10-tetrahydroazepino[3,4-b]indol-2-yl]-N-[(1S)-1-phenylethyl]hexanamide
Molecular weight565.718
Hydrogen bond acceptor4
Hydrogen bond donor4
XlogP3.8
SynonymsCHEMBL1186489
BDBM50254255
(5S)-6-oxo-5-[(4R)-3-oxo-4-[(phenylacetyl)amino]-3,4,5,10-tetrahydroazepino[3,4-b]indol-2(1H)-yl]-6-{[(1S)-1-phenylethyl]amino}hexan-1-aminium trifluoroacetate
Inchi KeyCJQHVGHBOCFMAH-CZXVKTRTSA-N
Inchi IDInChI=1S/C34H39N5O3/c1-23(25-14-6-3-7-15-25)36-33(41)31(18-10-11-19-35)39-22-30-27(26-16-8-9-17-28(26)37-30)21-29(34(39)42)38-32(40)20-24-12-4-2-5-13-24/h2-9,12-17,23,29,31,37H,10-11,18-22,35H2,1H3,(H,36,41)(H,38,40)/t23-,29+,31-/m0/s1
PubChem CID25188220
ChEMBLN/A
IUPHARN/A
BindingDB50254255
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.

Known GPCRs

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Total entries: 5
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
43621Somatostatin receptor type 1P30872SSTR1Homo sapiens (Human)391
43619Somatostatin receptor type 2P30874SSTR2Homo sapiens (Human)369
43620Somatostatin receptor type 3P32745SSTR3Homo sapiens (Human)418
43623Somatostatin receptor type 4P31391SSTR4Homo sapiens (Human)388
43622Somatostatin receptor type 5P35346SSTR5Homo sapiens (Human)364

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