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Ligand

NameCHEMBL192729
Molecular formulaC28H33N3O7
IUPAC name6-[[(2S)-2-(1-benzofuran-2-carbonylamino)-5-(phenylmethoxycarbonylamino)pentanoyl]amino]hexanoic acid
Molecular weight523.586
Hydrogen bond acceptor7
Hydrogen bond donor4
XlogP3.8
SynonymsSCHEMBL5653172
MFTMRQDQKJTSPG-QFIPXVFZSA-N
BDBM50165948
6-{(2S) -2-[(1-Benzofuran-2-ylcarbonyl)amino]-5-[benzyloxycarbonylamino]pentanoylamino}hexanoic acid
6-{(S)-2-[(Benzofuran-2-carbonyl)-amino]-5-benzyloxycarbonylamino-pentanoylamino}-hexanoic acid
Inchi KeyMFTMRQDQKJTSPG-QFIPXVFZSA-N
Inchi IDInChI=1S/C28H33N3O7/c32-25(33)15-5-2-8-16-29-26(34)22(31-27(35)24-18-21-12-6-7-14-23(21)38-24)13-9-17-30-28(36)37-19-20-10-3-1-4-11-20/h1,3-4,6-7,10-12,14,18,22H,2,5,8-9,13,15-17,19H2,(H,29,34)(H,30,36)(H,31,35)(H,32,33)/t22-/m0/s1
PubChem CID11249458
ChEMBLCHEMBL192729
IUPHARN/A
BindingDB50165948
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.

Known GPCRs

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Total entries: 9
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
204354Prostacyclin receptorP43119PTGIRHomo sapiens (Human)386
204355Prostaglandin D2 receptorQ13258PTGDRHomo sapiens (Human)359
204353Prostaglandin E2 receptor EP1 subtypeP34995PTGER1Homo sapiens (Human)402
204357Prostaglandin E2 receptor EP2 subtypeP43116PTGER2Homo sapiens (Human)358
204359Prostaglandin E2 receptor EP3 subtypeP43115PTGER3Homo sapiens (Human)390
204352Prostaglandin E2 receptor EP4 subtypeP35408PTGER4Homo sapiens (Human)488
204358Prostaglandin E2 receptor EP4 subtypeP43114Ptger4Rattus norvegicus (Rat)488
204351Prostaglandin F2-alpha receptorP43088PTGFRHomo sapiens (Human)359
204356Thromboxane A2 receptorP21731TBXA2RHomo sapiens (Human)343

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