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Ligand

NameCHEMBL3560331
Molecular formulaC20H20BrClN2O
IUPAC name(E)-3-(4-bromophenyl)-1-[4-[(4-chlorophenyl)methyl]piperazin-1-yl]prop-2-en-1-one
Molecular weight419.747
Hydrogen bond acceptor2
Hydrogen bond donor0
XlogP4.4
SynonymsSCHEMBL16598559
MLS-0472527.0001
SCHEMBL16598556
(e)-1-(4-(4-chlorobenzyl)piperazin-1-yl)-3-(4-bromophenyl)prop-2-en-1-one
ML401
Inchi KeyNXTNVQJKGHAGAX-BJMVGYQFSA-N
Inchi IDInChI=1S/C20H20BrClN2O/c21-18-6-1-16(2-7-18)5-10-20(25)24-13-11-23(12-14-24)15-17-3-8-19(22)9-4-17/h1-10H,11-15H2/b10-5+
PubChem CID73169083
ChEMBLCHEMBL3560331
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
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
492042G-protein coupled receptor 183P32249GPR183Homo sapiens (Human)361

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