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Ligand

NameCHEMBL2182042
Molecular formulaC26H24N4O4
IUPAC name2-[4-[4-[1-methyl-5-[[(1R)-1-phenylethoxy]carbonylamino]triazol-4-yl]phenyl]phenyl]acetic acid
Molecular weight456.502
Hydrogen bond acceptor6
Hydrogen bond donor2
XlogP4.2
SynonymsSCHEMBL16701163
{4'-[1-methyl-5-((R)-1-phenyl-ethoxycarbonylamino)-1H-[1,2,3]triazol-4-yl]-biphenyl-4-yl}-acetic acid
BDBM50398096
CTNSCPPHPORJPG-QGZVFWFLSA-N
Inchi KeyCTNSCPPHPORJPG-QGZVFWFLSA-N
Inchi IDInChI=1S/C26H24N4O4/c1-17(19-6-4-3-5-7-19)34-26(33)27-25-24(28-29-30(25)2)22-14-12-21(13-15-22)20-10-8-18(9-11-20)16-23(31)32/h3-15,17H,16H2,1-2H3,(H,27,33)(H,31,32)/t17-/m1/s1
PubChem CID71453960
ChEMBLCHEMBL2182042
IUPHARN/A
BindingDB50398096
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
50273Lysophosphatidic acid receptor 1Q92633LPAR1Homo sapiens (Human)364
50272Lysophosphatidic acid receptor 3Q9UBY5LPAR3Homo sapiens (Human)353

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