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Ligand

NameCHEMBL3326831
Molecular formulaC25H26F3N3O6S
IUPAC name(2S)-4-methyl-2-[[2-[5-[(4-methylphenyl)sulfonylamino]-3-(2,2,2-trifluoroacetyl)indol-1-yl]acetyl]amino]pentanoic acid
Molecular weight553.553
Hydrogen bond acceptor10
Hydrogen bond donor3
XlogP4.5
SynonymsN-[2-[5-[[(4-Methylphenyl)sulfonyl]amino]-3-(2,2,2-trifluoroacetyl)-1H-indol-1-yl]acetyl]-L-leucine
ZINC254286811
AKOS027470182
NTRC 824
1623002-61-8
[ Show all ]
Inchi KeySOOLLEBJNGCDOZ-FQEVSTJZSA-N
Inchi IDInChI=1S/C25H26F3N3O6S/c1-14(2)10-20(24(34)35)29-22(32)13-31-12-19(23(33)25(26,27)28)18-11-16(6-9-21(18)31)30-38(36,37)17-7-4-15(3)5-8-17/h4-9,11-12,14,20,30H,10,13H2,1-3H3,(H,29,32)(H,34,35)/t20-/m0/s1
PubChem CID101873359
ChEMBLCHEMBL3326831
IUPHARN/A
BindingDB50023628
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.

Known GPCRs

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Total entries: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
454393Neurotensin receptor type 1P20789Ntsr1Rattus norvegicus (Rat)424
454392Neurotensin receptor type 2Q63384Ntsr2Rattus norvegicus (Rat)416

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