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Ligand

NameBiphalin
Molecular formulaC46H56N10O10
IUPAC name(2S)-2-amino-N-[(2R)-1-[[2-[[(2S)-1-[2-[(2S)-2-[[2-[[(2R)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]propanoyl]amino]acetyl]amino]-3-phenylpropanoyl]hydrazinyl]-1-oxo-3-phenylpropan-2-yl]amino]-2-oxoethyl]amino]-1-oxopropan-2-yl]-3-(4-hydroxyphenyl)propanamide
Molecular weight909.014
Hydrogen bond acceptor12
Hydrogen bond donor12
XlogP1.4
Synonyms(Tyr-ala-gly-phe-NH2)2
D-Enk-O
Dala(2)
D-ENK
Bis(tyr-ala-gly-phenh2)hydrazide
[ Show all ]
Inchi KeyDESSEGDLRYOPTJ-VRANXALZSA-N
Inchi IDInChI=1S/C46H56N10O10/c1-27(51-43(63)35(47)21-31-13-17-33(57)18-14-31)41(61)49-25-39(59)53-37(23-29-9-5-3-6-10-29)45(65)55-56-46(66)38(24-30-11-7-4-8-12-30)54-40(60)26-50-42(62)28(2)52-44(64)36(48)22-32-15-19-34(58)20-16-32/h3-20,27-28,35-38,57-58H,21-26,47-48H2,1-2H3,(H,49,61)(H,50,62)(H,51,63)(H,52,64)(H,53,59)(H,54,60)(H,55,65)(H,56,66)/t27-,28-,35+,36+,37+,38+/m1/s1
PubChem CID5487663
ChEMBLCHEMBL200199
IUPHARN/A
BindingDB21014
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has more than 5 hydrogen bond donor.
This ligand has more than 10 hydrogen bond acceptor.
This ligand is heavier than 500 daltons.

Known GPCRs

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Total entries: 7
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
58124Delta-type opioid receptorP41143OPRD1Homo sapiens (Human)372
58127Delta-type opioid receptorP32300Oprd1Mus musculus (Mouse)372
58128Delta-type opioid receptorP33533Oprd1Rattus norvegicus (Rat)372
443980Kappa-type opioid receptorP34975Oprk1Rattus norvegicus (Rat)380
58125Mu-type opioid receptorP33535Oprm1Rattus norvegicus (Rat)398
58126Mu-type opioid receptorP35372OPRM1Homo sapiens (Human)400
58129Mu-type opioid receptorP97266OPRM1Cavia porcellus (Guinea pig)98

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