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Ligand

NameCHEMBL147319
Molecular formulaC32H41N5O4
IUPAC namemethyl (2R)-6-amino-2-[[(2R)-3-(1H-indol-3-yl)-2-(spiro[1,2-dihydroindene-3,4'-piperidine]-1'-carbonylamino)propanoyl]amino]hexanoate
Molecular weight559.711
Hydrogen bond acceptor5
Hydrogen bond donor4
XlogP3.9
SynonymsBDBM50075278
methyl 6-amino-2-[2-(1H-3-indolyl)-1-spiro[2,3-dihydro-1H-indene-1,4''-(hexahydropyridine)]-1-ylcarboxamido-(1R)-ethylcarboxamido]-(2R)-hexanoate
Inchi KeyHGHAEFXYQVJDKM-VSGBNLITSA-N
Inchi IDInChI=1S/C32H41N5O4/c1-41-30(39)27(12-6-7-17-33)35-29(38)28(20-23-21-34-26-11-5-3-9-24(23)26)36-31(40)37-18-15-32(16-19-37)14-13-22-8-2-4-10-25(22)32/h2-5,8-11,21,27-28,34H,6-7,12-20,33H2,1H3,(H,35,38)(H,36,40)/t27-,28-/m1/s1
PubChem CID44363921
ChEMBLCHEMBL147319
IUPHARN/A
BindingDB50075278
DrugBankN/A

Structure

SDF download

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

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
114083Somatostatin receptor type 2P30875Sstr2Mus musculus (Mouse)369

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