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Ligand

NameONO-3080573
Molecular formulaC31H34O7
IUPAC name1-[4-[(2S,3R)-2-(2,3-dihydro-1H-inden-2-yloxy)-3-(3,5-dimethoxy-4-methylphenyl)-3-hydroxypropoxy]phenyl]cyclopropane-1-carboxylic acid
Molecular weight518.606
Hydrogen bond acceptor7
Hydrogen bond donor2
XlogP4.8
Synonyms1-(4-{[(2s,3r)-2-(2,3-Dihydro-1h-Inden-2-Yloxy)-3-(3,5-Dimethoxy-4-Methylphenyl)-3-Hydroxypropyl]oxy}phenyl)cyclopropanecarboxylic Acid
1-[4-[(2S,3R)-2-(2,3-dihydro-1H-inden-2-yloxy)-3-(3,5-dimethoxy-4-methylphenyl)-3-hydroxypropoxy]phenyl]cyclopropane-1-carboxylic acid
D0N3YN
GTPL8588
ON3
Inchi KeyFVESDCZDESZGHA-URLMMPGGSA-N
Inchi IDInChI=1S/C31H34O7/c1-19-26(35-2)16-22(17-27(19)36-3)29(32)28(38-25-14-20-6-4-5-7-21(20)15-25)18-37-24-10-8-23(9-11-24)31(12-13-31)30(33)34/h4-11,16-17,25,28-29,32H,12-15,18H2,1-3H3,(H,33,34)/t28-,29+/m0/s1
PubChem CID91799238
ChEMBLN/A
IUPHAR8588
BindingDBN/A
DrugBankN/A

Structure

SDF download

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

Known GPCRs

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Total entries: 1
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GLASS IDNameUniProtGeneSpeciesLength
553699Lysophosphatidic acid receptor 1Q92633LPAR1Homo sapiens (Human)364

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