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Ligand

NameRonacaleret
Molecular formulaC25H31F2NO4
IUPAC name3-[3-[(2R)-3-[[1-(2,3-dihydro-1H-inden-2-yl)-2-methylpropan-2-yl]amino]-2-hydroxypropoxy]-4,5-difluorophenyl]propanoic acid
Molecular weight447.523
Hydrogen bond acceptor7
Hydrogen bond donor3
XlogP1.7
Synonyms3-[3-[(2R)-3-[[1-(2,3-dihydro-1H-inden-2-yl)-2-methylpropan-2-yl]amino]-2-hydroxypropoxy]-4,5-difluorophenyl]propanoic acid
CHEMBL1198855
SB 751689
753449-67-1
DB05255
[ Show all ]
Inchi KeyFQJISUPNMFRIFZ-HXUWFJFHSA-N
Inchi IDInChI=1S/C25H31F2NO4/c1-25(2,13-17-9-18-5-3-4-6-19(18)10-17)28-14-20(29)15-32-22-12-16(7-8-23(30)31)11-21(26)24(22)27/h3-6,11-12,17,20,28-29H,7-10,13-15H2,1-2H3,(H,30,31)/t20-/m1/s1
PubChem CID10345214
ChEMBLCHEMBL1198855
IUPHAR9473
BindingDB50346036
DrugBankDB05255

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand satisfies Lipinski's rule of five.

Known GPCRs

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Total entries: 3
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
548889Adhesion G-protein coupled receptor F1Q5T601ADGRF1Homo sapiens (Human)910
84771Extracellular calcium-sensing receptorP48442CasrRattus norvegicus (Rat)1079
84772Extracellular calcium-sensing receptorP41180CASRHomo sapiens (Human)1078

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