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Ligand

NameCHEMBL3315219
Molecular formulaC26H26N2O3
IUPAC name(2R)-4-methyl-2-[[2-(5-naphthalen-1-ylindol-1-yl)acetyl]amino]pentanoic acid
Molecular weight414.505
Hydrogen bond acceptor3
Hydrogen bond donor2
XlogP5.6
SynonymsBDBM50049004
Inchi KeyAFTDNGSNOSIHDJ-HSZRJFAPSA-N
Inchi IDInChI=1S/C26H26N2O3/c1-17(2)14-23(26(30)31)27-25(29)16-28-13-12-20-15-19(10-11-24(20)28)22-9-5-7-18-6-3-4-8-21(18)22/h3-13,15,17,23H,14,16H2,1-2H3,(H,27,29)(H,30,31)/t23-/m1/s1
PubChem CID118708054
ChEMBLCHEMBL3315219
IUPHARN/A
BindingDB50049004
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 1
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GLASS IDNameUniProtGeneSpeciesLength
441884Neurotensin receptor type 1P30989NTSR1Homo sapiens (Human)418

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