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Ligand

NameSubstance P, C-terminal pentapeptide
Molecular formulaC36H49N7O7S
IUPAC name(2S)-N-[(2S)-1-[[(2S)-1-[[2-[[(2S)-1-[[(2S)-1-amino-4-methylsulfanyl-1-oxobutan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-2-oxoethyl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]-5-oxopyrrolidine-2-carboxamide
Molecular weight723.89
Hydrogen bond acceptor8
Hydrogen bond donor7
XlogP2.1
Synonyms5-Oxo-pro-phe-phe-gly-leu-met-amide
BDBM50007963
L-Methioninamide, 5-oxo-L-prolyl-L-phenylalanyl-L-phenylalanylglycyl-L-leucyl-
Substance P (6-11), pyroglutamic acid-
6-Pglu-substance P (6-11)
[ Show all ]
Inchi KeyCTTLAZLIKHEYJW-ZIUUJSQJSA-N
Inchi IDInChI=1S/C36H49N7O7S/c1-22(2)18-27(35(49)41-25(32(37)46)16-17-51-3)40-31(45)21-38-33(47)28(19-23-10-6-4-7-11-23)42-36(50)29(20-24-12-8-5-9-13-24)43-34(48)26-14-15-30(44)39-26/h4-13,22,25-29H,14-21H2,1-3H3,(H2,37,46)(H,38,47)(H,39,44)(H,40,45)(H,41,49)(H,42,50)(H,43,48)/t25-,26-,27-,28-,29-/m0/s1
PubChem CID188348
ChEMBLCHEMBL441061
IUPHARN/A
BindingDB50007963
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: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
50427Neuromedin-K receptorP30098TACR3Cavia porcellus (Guinea pig)440
50428Substance-P receptorP30547TACR1Cavia porcellus (Guinea pig)407

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