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Ligand

NameCHEMBL146022
Molecular formulaC32H40N4O5
IUPAC name[(2R)-1-[[(2R)-6-amino-1-methoxy-1-oxohexan-2-yl]amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl] spiro[1,2-dihydroindene-3,4'-piperidine]-1'-carboxylate
Molecular weight560.695
Hydrogen bond acceptor6
Hydrogen bond donor3
XlogP4.5
SynonymsBDBM50075289
1-[5-amino-1-methyloxycarbonyl-(1R)-pentylcarbamoyl]-2-(1H-3-indolyl)-(1R)-ethyl spiro[2,3-dihydro-1H-indene-1,4''-(hexahydropyridine)]-1''-carboxylate
Inchi KeyRLJAGKCCDNSYPX-VSGBNLITSA-N
Inchi IDInChI=1S/C32H40N4O5/c1-40-30(38)27(12-6-7-17-33)35-29(37)28(20-23-21-34-26-11-5-3-9-24(23)26)41-31(39)36-18-15-32(16-19-36)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,35,37)/t27-,28-/m1/s1
PubChem CID44363920
ChEMBLCHEMBL146022
IUPHARN/A
BindingDB50075289
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
299000Somatostatin receptor type 2P30875Sstr2Mus musculus (Mouse)369

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