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Ligand

NameSCHEMBL805679
Molecular formulaC30H31F2N3O2
IUPAC name1-benzyl-3-N-[(3,4-difluorophenyl)methyl]-2-propan-2-yl-6-N-propylindole-3,6-dicarboxamide
Molecular weight503.594
Hydrogen bond acceptor4
Hydrogen bond donor2
XlogP5.9
SynonymsCHEMBL3655519
BDBM101183
US8524917, 156
Inchi KeyAZFBFWKEVAJEIS-UHFFFAOYSA-N
Inchi IDInChI=1S/C30H31F2N3O2/c1-4-14-33-29(36)22-11-12-23-26(16-22)35(18-20-8-6-5-7-9-20)28(19(2)3)27(23)30(37)34-17-21-10-13-24(31)25(32)15-21/h5-13,15-16,19H,4,14,17-18H2,1-3H3,(H,33,36)(H,34,37)
PubChem CID25060537
ChEMBLCHEMBL3655519
IUPHARN/A
BindingDB101183
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.
This ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
18086Sphingosine 1-phosphate receptor 3Q99500S1PR3Homo sapiens (Human)378

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