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Ligand

NameGT-GK
Molecular formulaC58H99N17O8
IUPAC name(2S)-6-amino-N-[11-[4-[4-[4-[11-[[(2R,3S)-3-hydroxy-2-(4-methyltriazol-1-yl)butanoyl]amino]undecanoyl]piperazin-1-yl]-6-[2-[2-(2-prop-2-ynoxyethoxy)ethoxy]ethylamino]-1,3,5-triazin-2-yl]piperazin-1-yl]-11-oxoundecyl]-2-(4-methyltriazol-1-yl)hexanamide
Molecular weight1162.54
Hydrogen bond acceptor19
Hydrogen bond donor5
XlogP5.4
SynonymsMLS002153683
SMR001231061
CHEMBL1982108
HMS2218D11
BDBM79259
[ Show all ]
Inchi KeyAGJRXCFJPQXZKA-HUIFRNELSA-N
Inchi IDInChI=1S/C58H99N17O8/c1-5-39-81-41-43-83-44-42-82-40-30-62-56-63-57(72-35-31-70(32-36-72)51(77)25-18-14-10-6-8-12-16-22-28-60-54(79)50(24-20-21-27-59)74-45-47(2)66-68-74)65-58(64-56)73-37-33-71(34-38-73)52(78)26-19-15-11-7-9-13-17-23-29-61-55(80)53(49(4)76)75-46-48(3)67-69-75/h1,45-46,49-50,53,76H,6-44,59H2,2-4H3,(H,60,79)(H,61,80)(H,62,63,64,65)/t49-,50-,53+/m0/s1
PubChem CID25163001
ChEMBLCHEMBL1982108
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has more than 10 hydrogen bond acceptor.
This ligand is heavier than 500 daltons.
This ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
4932Glucagon-like peptide 1 receptorP43220GLP1RHomo sapiens (Human)463

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