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Ligand

NameCHEMBL3955736
Molecular formulaC30H29F2NO4
IUPAC name2-[3-[5-fluoro-2-[2-[1-(4-fluorophenyl)cyclobutyl]acetyl]-3,4-dihydro-1H-isoquinolin-8-yl]-4-methoxyphenyl]acetic acid
Molecular weight505.562
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP5.6
SynonymsBDBM205782
SCHEMBL15056006
US9255090, 251
Inchi KeyACXKFTYVDIBZMD-UHFFFAOYSA-N
Inchi IDInChI=1S/C30H29F2NO4/c1-37-27-10-3-19(16-29(35)36)15-24(27)22-8-9-26(32)23-11-14-33(18-25(22)23)28(34)17-30(12-2-13-30)20-4-6-21(31)7-5-20/h3-10,15H,2,11-14,16-18H2,1H3,(H,35,36)
PubChem CID89648599
ChEMBLCHEMBL3955736
IUPHARN/A
BindingDB205782
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
517327Prostaglandin D2 receptor 2Q9Y5Y4PTGDR2Homo sapiens (Human)395

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