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Ligand

NameCHEMBL451169
Molecular formulaC32H45N5O6
IUPAC name(3S,6S,9S,12R)-3-[(2S)-butan-2-yl]-6-[(1-methoxyindol-3-yl)methyl]-9-(5-oxohexyl)-1,4,7,10-tetrazabicyclo[10.4.0]hexadecane-2,5,8,11-tetrone
Molecular weight595.741
Hydrogen bond acceptor6
Hydrogen bond donor3
XlogP3.4
SynonymsCyclo[D-Hpr-6-(1-oxoethyl)-L-Nle-1-methoxy-L-Trp-L-Ile-]
(3S,6S,9S,15aR)-9-sec-butyl-6-((1-methoxy-1H-indol-3-yl)methyl)-3-(5-oxohexyl)octahydro-1H-pyrido[1,2-a][1,4,7,10]tetraazacyclododecine-1,4,7,10(12H,13H,14H)-tetraone
BDBM50256746
Inchi KeySLNRKQPBCJPWHD-DVORCMKRSA-N
Inchi IDInChI=1S/C32H45N5O6/c1-5-20(2)28-32(42)36-17-11-10-16-27(36)31(41)33-24(14-8-6-12-21(3)38)29(39)34-25(30(40)35-28)18-22-19-37(43-4)26-15-9-7-13-23(22)26/h7,9,13,15,19-20,24-25,27-28H,5-6,8,10-12,14,16-18H2,1-4H3,(H,33,41)(H,34,39)(H,35,40)/t20-,24-,25-,27+,28-/m0/s1
PubChem CID44572098
ChEMBLCHEMBL451169
IUPHARN/A
BindingDB50256746
DrugBankN/A

Structure

SDF download

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

Known GPCRs

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Total entries: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
317355Galanin receptor type 1Q62805Galr1Rattus norvegicus (Rat)346
317354Galanin receptor type 2O08726Galr2Rattus norvegicus (Rat)372

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