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Ligand

NameCHEMBL3560573
Molecular formulaC20H19BrF2N2O
IUPAC name(E)-3-(4-bromophenyl)-1-[4-[(3,5-difluorophenyl)methyl]piperazin-1-yl]prop-2-en-1-one
Molecular weight421.286
Hydrogen bond acceptor4
Hydrogen bond donor0
XlogP4.0
SynonymsMLS-0472535.0001
SCHEMBL16598638
SCHEMBL16598641
Inchi KeyALWZDEOVAJDSBI-ZZXKWVIFSA-N
Inchi IDInChI=1S/C20H19BrF2N2O/c21-17-4-1-15(2-5-17)3-6-20(26)25-9-7-24(8-10-25)14-16-11-18(22)13-19(23)12-16/h1-6,11-13H,7-10,14H2/b6-3+
PubChem CID73330398
ChEMBLCHEMBL3560573
IUPHARN/A
BindingDBN/A
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
463916G-protein coupled receptor 183P32249GPR183Homo sapiens (Human)361

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