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Ligand

NameCHEMBL476240
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-[(1R)-1-phenylethyl]hexanamide
Molecular weight565.718
Hydrogen bond acceptor4
Hydrogen bond donor4
XlogP3.8
SynonymsBDBM50254254
(5S)-6-oxo-5-[(4R)-3-oxo-4-[(phenylacetyl)amino]-3,4,5,10-tetrahydroazepino[3,4-b]indol-2(1H)-yl]-6-{[(1R)-1-phenylethyl]amino}hexan-1-aminium trifluoroacetate
CHEMBL1186753
Inchi KeyCJQHVGHBOCFMAH-RUVNJYGYSA-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+/m1/s1
PubChem CID25188218
ChEMBLN/A
IUPHARN/A
BindingDB50254254
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
43625Somatostatin receptor type 1P30872SSTR1Homo sapiens (Human)391
43624Somatostatin receptor type 2P30874SSTR2Homo sapiens (Human)369
43626Somatostatin receptor type 3P32745SSTR3Homo sapiens (Human)418
43628Somatostatin receptor type 4P31391SSTR4Homo sapiens (Human)388
43627Somatostatin receptor type 5P35346SSTR5Homo sapiens (Human)364

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