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Ligand

NameIci-174864
Molecular formulaC34H46N4O6
IUPAC name(2S)-2-[[(2S)-2-[[2-[[(2S)-2-[bis(prop-2-enyl)amino]-3-(4-hydroxyphenyl)propanoyl]amino]-2-methylpropanoyl]amino]-3-phenylpropanoyl]amino]-4-methylpentanoic acid
Molecular weight606.764
Hydrogen bond acceptor7
Hydrogen bond donor5
XlogP2.8
SynonymsL-Leucine, N,N-di-2-propenyl-L-tyrosyl-2-methylalanyl-L-phenylalanyl-
SCHEMBL4402752
D0B3BJ
n,n-di(prop-2-en-1-yl)-l-tyrosyl-2-methylalanyl-l-phenylalanyl-l-leucine
(2S)-2-[[(2S)-2-[[2-[[(2S)-2-(di(prop-2-enyl)amino)-3-(4-hydroxyphenyl)propanoyl]amino]-2-methylpropanoyl]amino]-3-phenylpropanoyl]amino]-4-methylpentanoic acid
[ Show all ]
Inchi KeyBGJPRBZZLWCLJW-AWCRTANDSA-N
Inchi IDInChI=1S/C34H46N4O6/c1-7-18-38(19-8-2)29(22-25-14-16-26(39)17-15-25)31(41)37-34(5,6)33(44)36-27(21-24-12-10-9-11-13-24)30(40)35-28(32(42)43)20-23(3)4/h7-17,23,27-29,39H,1-2,18-22H2,3-6H3,(H,35,40)(H,36,44)(H,37,41)(H,42,43)/t27-,28-,29-/m0/s1
PubChem CID107691
ChEMBLN/A
IUPHAR1636
BindingDBN/A
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
553350Delta-type opioid receptorP33533Oprd1Rattus norvegicus (Rat)372

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