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Ligand

NameCHEMBL193592
Molecular formulaC25H27FN4O
IUPAC name1-(4-fluorophenyl)-3-[2-phenyl-2-(4-phenylpiperazin-1-yl)ethyl]urea
Molecular weight418.516
Hydrogen bond acceptor4
Hydrogen bond donor2
XlogP4.2
SynonymsBDBM50162368
SCHEMBL18840933
1-(4-Fluoro-phenyl)-3-[2-phenyl-2-(4-phenyl-piperazin-1-yl)-ethyl]-urea
Inchi KeyAYHZXPXNRGUEPG-UHFFFAOYSA-N
Inchi IDInChI=1S/C25H27FN4O/c26-21-11-13-22(14-12-21)28-25(31)27-19-24(20-7-3-1-4-8-20)30-17-15-29(16-18-30)23-9-5-2-6-10-23/h1-14,24H,15-19H2,(H2,27,28,31)
PubChem CID44401209
ChEMBLCHEMBL193592
IUPHARN/A
BindingDB50162368
DrugBankN/A

Structure

SDF download

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

Known GPCRs

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Total entries: 1
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GLASS IDNameUniProtGeneSpeciesLength
17478C-C chemokine receptor type 3P51677CCR3Homo sapiens (Human)355

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