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Ligand

NameSCHEMBL15596961
Molecular formulaC31H24F4N4O4
IUPAC name1-[2-[4-(6-fluoro-1,3-benzoxazol-2-yl)-7-hydroxy-3,3-dimethyl-2H-indol-1-yl]phenyl]-3-[4-(trifluoromethoxy)phenyl]urea
Molecular weight592.551
Hydrogen bond acceptor10
Hydrogen bond donor3
XlogP7.5
SynonymsUS9540323, 92
US9540323, 98
Inchi KeyAQPUDLXYSUGWMQ-UHFFFAOYSA-N
Inchi IDInChI=1S/C31H24F4N4O4/c1-30(2)16-39(27-24(40)14-12-20(26(27)30)28-37-22-13-7-17(32)15-25(22)42-28)23-6-4-3-5-21(23)38-29(41)36-18-8-10-19(11-9-18)43-31(33,34)35/h3-15,40H,16H2,1-2H3,(H2,36,38,41)
PubChem CID136612377
ChEMBLN/A
IUPHARN/A
BindingDB260901
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
557627P2Y purinoceptor 1P47900P2RY1Homo sapiens (Human)373

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