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Ligand

NameCHEMBL3326832
Molecular formulaC23H27N3O5S
IUPAC name(2S)-4-methyl-2-[[2-[5-[(4-methylphenyl)sulfonylamino]indol-1-yl]acetyl]amino]pentanoic acid
Molecular weight457.545
Hydrogen bond acceptor6
Hydrogen bond donor3
XlogP3.7
SynonymsBDBM50023627
Inchi KeyXXWMOYGHYXDSBO-FQEVSTJZSA-N
Inchi IDInChI=1S/C23H27N3O5S/c1-15(2)12-20(23(28)29)24-22(27)14-26-11-10-17-13-18(6-9-21(17)26)25-32(30,31)19-7-4-16(3)5-8-19/h4-11,13,15,20,25H,12,14H2,1-3H3,(H,24,27)(H,28,29)/t20-/m0/s1
PubChem CID118711921
ChEMBLCHEMBL3326832
IUPHARN/A
BindingDB50023627
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand satisfies Lipinski's rule of five.

Known GPCRs

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Total entries: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
457734Neurotensin receptor type 1P20789Ntsr1Rattus norvegicus (Rat)424
457735Neurotensin receptor type 2Q63384Ntsr2Rattus norvegicus (Rat)416

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