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Ligand

NameH-Aba-Gly-Gly-Phe-Leu-OH
Molecular formulaC29H37N7O6S
IUPAC name(2S)-2-[[(2S)-2-[[2-[[2-[[(2S)-2-amino-3-(2-amino-1,3-benzothiazol-6-yl)propanoyl]amino]acetyl]amino]acetyl]amino]-3-phenylpropanoyl]amino]-4-methylpentanoic acid
Molecular weight611.718
Hydrogen bond acceptor10
Hydrogen bond donor7
XlogP-0.2
SynonymsCHEMBL247759
D07JIQ
BDBM50207836
Inchi KeyAHRIYJIWFATUOS-BVSLBCMMSA-N
Inchi IDInChI=1S/C29H37N7O6S/c1-16(2)10-22(28(41)42)35-27(40)21(12-17-6-4-3-5-7-17)34-25(38)15-32-24(37)14-33-26(39)19(30)11-18-8-9-20-23(13-18)43-29(31)36-20/h3-9,13,16,19,21-22H,10-12,14-15,30H2,1-2H3,(H2,31,36)(H,32,37)(H,33,39)(H,34,38)(H,35,40)(H,41,42)/t19-,21-,22-/m0/s1
PubChem CID44439882
ChEMBLCHEMBL247759
IUPHARN/A
BindingDB50207836
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has more than 5 hydrogen bond donor.
This ligand is heavier than 500 daltons.

Known GPCRs

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Total entries: 3
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
5821Delta-type opioid receptorP41143OPRD1Homo sapiens (Human)372
5822Kappa-type opioid receptorP41145OPRK1Homo sapiens (Human)380
5823Mu-type opioid receptorP35372OPRM1Homo sapiens (Human)400

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