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Ligand

NameCHEMBL503379
Molecular formulaC41H48F3N7O7S
IUPAC nameN-[(4R)-2-[(2S)-6-amino-1-(benzylamino)-1-oxohexan-2-yl]-3-oxo-1,4,5,10-tetrahydroazepino[3,4-b]indol-4-yl]-1-methylsulfonylspiro[2H-indole-3,4'-piperidine]-1'-carboxamide;2,2,2-trifluoroacetic acid
Molecular weight839.932
Hydrogen bond acceptor12
Hydrogen bond donor5
XlogPNone
SynonymsN/A
Inchi KeyAOROARHDUIGAQH-ZATLWKIUSA-N
Inchi IDInChI=1S/C39H47N7O5S.C2HF3O2/c1-52(50,51)46-26-39(30-14-6-8-16-34(30)46)18-21-44(22-19-39)38(49)43-32-23-29-28-13-5-7-15-31(28)42-33(29)25-45(37(32)48)35(17-9-10-20-40)36(47)41-24-27-11-3-2-4-12-27;3-2(4,5)1(6)7/h2-8,11-16,32,35,42H,9-10,17-26,40H2,1H3,(H,41,47)(H,43,49);(H,6,7)/t32-,35+;/m1./s1
PubChem CID25187952
ChEMBLCHEMBL503379
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has more than 10 hydrogen bond acceptor.
This ligand is heavier than 500 daltons.
Partition coefficient log P of this ligand is not available.

Known GPCRs

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Total entries: 5
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
10541Somatostatin receptor type 1P30872SSTR1Homo sapiens (Human)391
10540Somatostatin receptor type 2P30874SSTR2Homo sapiens (Human)369
10537Somatostatin receptor type 3P32745SSTR3Homo sapiens (Human)418
10539Somatostatin receptor type 4P31391SSTR4Homo sapiens (Human)388
10538Somatostatin receptor type 5P35346SSTR5Homo sapiens (Human)364

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