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Ligand

Namebeta3-tetrapeptide
Molecular formulaC35H46N6O7
IUPAC name(3S)-3-[[2-[[(3S)-3-acetamido-4-(3-hydroxyphenyl)butanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]-7-amino-N-[(2R,3R)-2-methyl-5-oxooxolan-3-yl]heptanamide
Molecular weight662.788
Hydrogen bond acceptor8
Hydrogen bond donor7
XlogP1.5
SynonymsD06AVM
GTPL2078
Inchi KeyGQYXVIIYXPRQJK-JZYDGZRSSA-N
Inchi IDInChI=1S/C35H46N6O7/c1-21-30(19-34(46)48-21)40-32(44)17-25(9-5-6-13-36)39-35(47)31(16-24-20-37-29-12-4-3-11-28(24)29)41-33(45)18-26(38-22(2)42)14-23-8-7-10-27(43)15-23/h3-4,7-8,10-12,15,20-21,25-26,30-31,37,43H,5-6,9,13-14,16-19,36H2,1-2H3,(H,38,42)(H,39,47)(H,40,44)(H,41,45)/t21-,25+,26+,30-,31?/m1/s1
PubChem CID73755026
ChEMBLN/A
IUPHAR2078
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: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
553759Somatostatin receptor type 4P49660Sstr4Mus musculus (Mouse)385
553760Somatostatin receptor type 4P31391SSTR4Homo sapiens (Human)388

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