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Ligand

NameCHEMBL1643775
Molecular formulaC22H20F4N2O4S
IUPAC name2-[(7R)-7-[(4-fluorophenyl)sulfonyl-methylamino]-3-(trifluoromethyl)-6,7,8,9-tetrahydropyrido[1,2-a]indol-10-yl]acetic acid
Molecular weight484.466
Hydrogen bond acceptor9
Hydrogen bond donor1
XlogP3.7
SynonymsBDBM50333870
(R)-2-(7-(4-fluoro-N-methylphenylsulfonamido)-3-(trifluoromethyl)-6,7,8,9-tetrahydropyrido[1,2-a]indol-10-yl)acetic acid
Inchi KeyBAURARYTOUFKMG-OAHLLOKOSA-N
Inchi IDInChI=1S/C22H20F4N2O4S/c1-27(33(31,32)16-6-3-14(23)4-7-16)15-5-9-19-18(11-21(29)30)17-8-2-13(22(24,25)26)10-20(17)28(19)12-15/h2-4,6-8,10,15H,5,9,11-12H2,1H3,(H,29,30)/t15-/m1/s1
PubChem CID53324589
ChEMBLCHEMBL1643775
IUPHARN/A
BindingDB50333870
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: 3
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
19206Prostaglandin D2 receptorQ13258PTGDRHomo sapiens (Human)359
19204Prostaglandin D2 receptor 2Q9Y5Y4PTGDR2Homo sapiens (Human)395
19205Thromboxane A2 receptorP21731TBXA2RHomo sapiens (Human)343

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