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Ligand

NameCHEMBL15032
Molecular formulaC42H49N5O7
IUPAC name(2S)-2-[[(2S)-2-[[2-[[2-[[(2S)-2-(dibenzylamino)-3-(4-hydroxyphenyl)propanoyl]amino]acetyl]amino]acetyl]amino]-3-phenylpropanoyl]amino]-4-methylpentanoic acid
Molecular weight735.882
Hydrogen bond acceptor8
Hydrogen bond donor6
XlogP3.3
SynonymsN,N-Dibenzyl-Tyr-Gly-Gly-Phe-Leu-OH
Inchi KeyCFOIEAVNWPDREA-FSEITFBQSA-N
Inchi IDInChI=1S/C42H49N5O7/c1-29(2)22-36(42(53)54)46-40(51)35(23-30-12-6-3-7-13-30)45-39(50)26-43-38(49)25-44-41(52)37(24-31-18-20-34(48)21-19-31)47(27-32-14-8-4-9-15-32)28-33-16-10-5-11-17-33/h3-21,29,35-37,48H,22-28H2,1-2H3,(H,43,49)(H,44,52)(H,45,50)(H,46,51)(H,53,54)/t35-,36-,37-/m0/s1
PubChem CID44270104
ChEMBLCHEMBL15032
IUPHARN/A
BindingDBN/A
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: 7
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
40815Delta-type opioid receptorP41143OPRD1Homo sapiens (Human)372
40817Delta-type opioid receptorP32300Oprd1Mus musculus (Mouse)372
443306Delta-type opioid receptorP33533Oprd1Rattus norvegicus (Rat)372
40819Kappa-type opioid receptorP41144OPRK1Cavia porcellus (Guinea pig)380
40816Mu-type opioid receptorP97266OPRM1Cavia porcellus (Guinea pig)98
40818Mu-type opioid receptorP35372OPRM1Homo sapiens (Human)400
40820Mu-type opioid receptorP42866Oprm1Mus musculus (Mouse)398

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