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Ligand

NameCHEMBL126520
Molecular formulaC29H32FN3O4
IUPAC namemethyl 3-[[4-[(4-fluorophenyl)methyl]piperidin-1-yl]methyl]-4-[(3-methoxyphenyl)carbamoylamino]benzoate
Molecular weight505.59
Hydrogen bond acceptor6
Hydrogen bond donor2
XlogP4.9
SynonymsBDBM50117428
SCHEMBL6702466
3-[4-(4-Fluoro-benzyl)-piperidin-1-ylmethyl]-4-[3-(3-methoxy-phenyl)-ureido]-benzoic acid methyl ester
Inchi KeyAZNIXHOAQCCYOH-UHFFFAOYSA-N
Inchi IDInChI=1S/C29H32FN3O4/c1-36-26-5-3-4-25(18-26)31-29(35)32-27-11-8-22(28(34)37-2)17-23(27)19-33-14-12-21(13-15-33)16-20-6-9-24(30)10-7-20/h3-11,17-18,21H,12-16,19H2,1-2H3,(H2,31,32,35)
PubChem CID10983980
ChEMBLCHEMBL126520
IUPHARN/A
BindingDB50117428
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
18349C-C chemokine receptor type 3P51677CCR3Homo sapiens (Human)355

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