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Ligand

NameCHEMBL1641817
Molecular formulaC26H28FN3O3
IUPAC name2-[(8R)-8-[[1-(4-fluorophenyl)cyclopentanecarbonyl]-methylamino]-6,7,8,9-tetrahydropyrido[3,2-b]indolizin-5-yl]acetic acid
Molecular weight449.526
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP3.8
Synonyms(R)-2-(8-(1-(4-fluorophenyl)-N-methylcyclopentanecarboxamido)-6,7,8,9-tetrahydropyrido[3,2-b]indolizin-5-yl)acetic acid
BLYMEBNUHVMONG-LJQANCHMSA-N
SCHEMBL2214953
{(8R)-8-[{[1-(4-fluorophenyl)cyclopentyl]carbonyl}(methyl)amino]-6,7,8,9-tetrahydro-pyrido[3,2-b]indolizin-5-yl}acetic acid
BDBM50333491
Inchi KeyBLYMEBNUHVMONG-LJQANCHMSA-N
Inchi IDInChI=1S/C26H28FN3O3/c1-29(25(33)26(12-2-3-13-26)17-6-8-18(27)9-7-17)19-10-11-22-21(15-23(31)32)20-5-4-14-28-24(20)30(22)16-19/h4-9,14,19H,2-3,10-13,15-16H2,1H3,(H,31,32)/t19-/m1/s1
PubChem CID45110109
ChEMBLCHEMBL1641817
IUPHARN/A
BindingDB50333491
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
27110Prostaglandin D2 receptorQ13258PTGDRHomo sapiens (Human)359
27109Prostaglandin D2 receptor 2Q9Y5Y4PTGDR2Homo sapiens (Human)395
27111Thromboxane A2 receptorP21731TBXA2RHomo sapiens (Human)343

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