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Ligand

NameCHEMBL2181755
Molecular formulaC22H23ClFNO4
IUPAC name(2S)-2-[2-[3-chloro-4-(2,2-dimethylpyrrolidine-1-carbonyl)phenyl]-4-fluorophenoxy]propanoic acid
Molecular weight419.877
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP4.8
Synonyms(2S)-2-({3'-chloro-4'-[(2,2-dimethylpyrrolidin-1-yl)carbonyl]-5-fluorobiphenyl-2-yl}oxy)propanoic acid
BDBM50397642
SCHEMBL4088114
AFIDJUXVZLKEJK-ZDUSSCGKSA-N
Inchi KeyAFIDJUXVZLKEJK-ZDUSSCGKSA-N
Inchi IDInChI=1S/C22H23ClFNO4/c1-13(21(27)28)29-19-8-6-15(24)12-17(19)14-5-7-16(18(23)11-14)20(26)25-10-4-9-22(25,2)3/h5-8,11-13H,4,9-10H2,1-3H3,(H,27,28)/t13-/m0/s1
PubChem CID44249133
ChEMBLCHEMBL2181755
IUPHARN/A
BindingDB50397642
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand satisfies Lipinski's rule of five.

Known GPCRs

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Total entries: 1
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
4173Prostaglandin D2 receptor 2Q9Y5Y4PTGDR2Homo sapiens (Human)395

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