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Ligand

NameSCHEMBL289923
Molecular formulaC29H30F2N2O2
IUPAC name1-benzyl-N-[(3,4-difluorophenyl)methyl]-2-propan-2-yl-6-propoxyindole-3-carboxamide
Molecular weight476.568
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP6.6
SynonymsUS8563594, 169
1-Benzyl-N-(3,4-difluorobenzyl)-2-isopropyl-6-propoxy-1H-indole-3-carboxamide
BDBM101038
US8524917, 11
AFDUGVKJXKJJMO-UHFFFAOYSA-N
[ Show all ]
Inchi KeyAFDUGVKJXKJJMO-UHFFFAOYSA-N
Inchi IDInChI=1S/C29H30F2N2O2/c1-4-14-35-22-11-12-23-26(16-22)33(18-20-8-6-5-7-9-20)28(19(2)3)27(23)29(34)32-17-21-10-13-24(30)25(31)15-21/h5-13,15-16,19H,4,14,17-18H2,1-3H3,(H,32,34)
PubChem CID25059488
ChEMBLCHEMBL3651714
IUPHARN/A
BindingDB101038
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
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
4069Sphingosine 1-phosphate receptor 3Q99500S1PR3Homo sapiens (Human)378

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