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Ligand

NameSpinorphin
Molecular formulaC45H64N8O10
IUPAC name(2S,3R)-2-[[(2S)-2-[[(2S)-1-[(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-amino-4-methylpentanoyl]amino]-3-methylbutanoyl]amino]-3-methylbutanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]pyrrolidine-2-carbonyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]-3-hydroxybutanoic acid
Molecular weight877.053
Hydrogen bond acceptor11
Hydrogen bond donor10
XlogP1.0
SynonymsCTK0H5736
Leucyl-valyl-valyl-tyrosyl-prolyl-tryptophyl-threonine
137201-62-8
GTPL1026
BDBM50219120
[ Show all ]
Inchi KeyBXIFNVGZIMFBQB-DYDSHOKNSA-N
Inchi IDInChI=1S/C45H64N8O10/c1-23(2)19-31(46)39(56)50-37(25(5)6)43(60)51-36(24(3)4)42(59)49-34(20-27-14-16-29(55)17-15-27)44(61)53-18-10-13-35(53)41(58)48-33(40(57)52-38(26(7)54)45(62)63)21-28-22-47-32-12-9-8-11-30(28)32/h8-9,11-12,14-17,22-26,31,33-38,47,54-55H,10,13,18-21,46H2,1-7H3,(H,48,58)(H,49,59)(H,50,56)(H,51,60)(H,52,57)(H,62,63)/t26-,31+,33+,34+,35+,36+,37+,38+/m1/s1
PubChem CID3081832
ChEMBLN/A
IUPHAR1026
BindingDBN/A
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: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
553427fMet-Leu-Phe receptorP21462FPR1Homo sapiens (Human)350
553428fMet-Leu-Phe receptorP33766Fpr1Mus musculus (Mouse)364

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