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Ligand

NameCHEMBL3314310
Molecular formulaC30H24F5N3O3
IUPAC name1-[2-[6-fluoro-4-(4-fluorophenyl)-7-hydroxy-3,3-dimethyl-2H-indol-1-yl]phenyl]-3-[4-(trifluoromethoxy)phenyl]urea
Molecular weight569.532
Hydrogen bond acceptor9
Hydrogen bond donor3
XlogP7.7
SynonymsBDBM50045631
SCHEMBL15596993
Inchi KeyBENMEJNWNXDMOH-UHFFFAOYSA-N
Inchi IDInChI=1S/C30H24F5N3O3/c1-29(2)16-38(26-25(29)21(15-22(32)27(26)39)17-7-9-18(31)10-8-17)24-6-4-3-5-23(24)37-28(40)36-19-11-13-20(14-12-19)41-30(33,34)35/h3-15,39H,16H2,1-2H3,(H2,36,37,40)
PubChem CID90062999
ChEMBLCHEMBL3314310
IUPHARN/A
BindingDB50045631
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
442517P2Y purinoceptor 1P47900P2RY1Homo sapiens (Human)373

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