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Ligand

NameCHEMBL2182062
Molecular formulaC31H31N3O4
IUPAC nameethyl 1-[4-[4-[1-methyl-5-[[(1R)-1-phenylethoxy]carbonylamino]pyrazol-4-yl]phenyl]phenyl]cyclopropane-1-carboxylate
Molecular weight509.606
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP5.8
SynonymsBDBM50398102
1-{4'-[1-methyl-5-((R)-1-phenyl-ethoxycarbonylamino)-1H-pyrazol-4-yl]-biphenyl-4-yl}-cyclopropanecarboxylic acid ethyl ester
BKOZVMQVDMNHQR-OAQYLSRUSA-N
SCHEMBL17077062
Inchi KeyBKOZVMQVDMNHQR-OAQYLSRUSA-N
Inchi IDInChI=1S/C31H31N3O4/c1-4-37-29(35)31(18-19-31)26-16-14-24(15-17-26)23-10-12-25(13-11-23)27-20-32-34(3)28(27)33-30(36)38-21(2)22-8-6-5-7-9-22/h5-17,20-21H,4,18-19H2,1-3H3,(H,33,36)/t21-/m1/s1
PubChem CID71450323
ChEMBLCHEMBL2182062
IUPHARN/A
BindingDB50398102
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.
This ligand has a partition coefficient log P greater than 5.

Known GPCRs

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Total entries: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
25977Lysophosphatidic acid receptor 1Q92633LPAR1Homo sapiens (Human)364
25976Lysophosphatidic acid receptor 3Q9UBY5LPAR3Homo sapiens (Human)353

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