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Ligand

NameCHEMBL1095117
Molecular formulaC29H31F2NO4
IUPAC name3-[4-(3,5-difluorophenoxy)-2-[[(1R)-1-(3,5-dimethylphenyl)-3-methylbutyl]carbamoyl]phenyl]propanoic acid
Molecular weight495.567
Hydrogen bond acceptor6
Hydrogen bond donor2
XlogP6.6
SynonymsSCHEMBL4505662
3-[4-(3,5-Difluorophenoxy)-2-({[(1R)-1-(3,5-dimethylphenyl)-3-methylbutyl]amino}carbonyl)phenyl]propanoic acid
BDBM50317900
Inchi KeyBSISWJVFEHGQBT-HHHXNRCGSA-N
Inchi IDInChI=1S/C29H31F2NO4/c1-17(2)9-27(21-11-18(3)10-19(4)12-21)32-29(35)26-16-24(7-5-20(26)6-8-28(33)34)36-25-14-22(30)13-23(31)15-25/h5,7,10-17,27H,6,8-9H2,1-4H3,(H,32,35)(H,33,34)/t27-/m1/s1
PubChem CID10368531
ChEMBLCHEMBL1095117
IUPHARN/A
BindingDB50317900
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
31710Prostaglandin E2 receptor EP1 subtypeP35375Ptger1Mus musculus (Mouse)405
31708Prostaglandin E2 receptor EP2 subtypeQ62053Ptger2Mus musculus (Mouse)362
31709Prostaglandin E2 receptor EP3 subtypeP30557Ptger3Mus musculus (Mouse)365
31707Prostaglandin E2 receptor EP4 subtypeP32240Ptger4Mus musculus (Mouse)513

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