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Ligand

NameCHEMBL1094419
Molecular formulaC30H35NO4
IUPAC name3-[2-[[(1R)-1-(3,5-dimethylphenyl)-3-methylbutyl]carbamoyl]-4-(phenoxymethyl)phenyl]propanoic acid
Molecular weight473.613
Hydrogen bond acceptor4
Hydrogen bond donor2
XlogP6.4
SynonymsBDBM50317914
SCHEMBL2985082
3-[2-({[(1R)-1-(3,5-Dimethylphenyl)-3-methylbutyl]amino}-carbonyl)-4-(phenoxymethyl)phenyl]propanoic acid
Inchi KeyALKDPZDQOKEMAM-MUUNZHRXSA-N
Inchi IDInChI=1S/C30H35NO4/c1-20(2)14-28(25-16-21(3)15-22(4)17-25)31-30(34)27-18-23(10-11-24(27)12-13-29(32)33)19-35-26-8-6-5-7-9-26/h5-11,15-18,20,28H,12-14,19H2,1-4H3,(H,31,34)(H,32,33)/t28-/m1/s1
PubChem CID46887719
ChEMBLCHEMBL1094419
IUPHARN/A
BindingDB50317914
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 4
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
8330Prostaglandin E2 receptor EP1 subtypeP35375Ptger1Mus musculus (Mouse)405
8331Prostaglandin E2 receptor EP2 subtypeQ62053Ptger2Mus musculus (Mouse)362
8328Prostaglandin E2 receptor EP3 subtypeP30557Ptger3Mus musculus (Mouse)365
8329Prostaglandin E2 receptor EP4 subtypeP32240Ptger4Mus musculus (Mouse)513

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