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Ligand

NameMLS000551396
Molecular formulaC22H20BrClN4O3
IUPAC name4-[4-[6-bromo-4-(2-chlorophenyl)quinazolin-2-yl]piperazin-1-yl]-4-oxobutanoic acid
Molecular weight503.781
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP3.7
SynonymsSMR000145321
4-[4-[6-bromo-4-(2-chlorophenyl)quinazolin-2-yl]piperazin-1-yl]-4-oxobutanoic acid
4-{4-[6-Bromo-4-(2-chloro-phenyl)-quinazolin-2-yl]-piperazin-1-yl}-4-oxo-butyric acid
4-{4-[6-bromo-4-(2-chlorophenyl)quinazolin-2-yl]piperazin-1-yl}-4-oxobutanoic acid
AC1LR1RG
[ Show all ]
Inchi KeyCJWRZEGXLDKDGH-UHFFFAOYSA-N
Inchi IDInChI=1S/C22H20BrClN4O3/c23-14-5-6-18-16(13-14)21(15-3-1-2-4-17(15)24)26-22(25-18)28-11-9-27(10-12-28)19(29)7-8-20(30)31/h1-6,13H,7-12H2,(H,30,31)
PubChem CID1386650
ChEMBLCHEMBL1333441
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.

Known GPCRs

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Total entries: 5
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
43774Neuropeptide S receptorQ6W5P4NPSR1Homo sapiens (Human)371
468281Parathyroid hormone/parathyroid hormone-related peptide receptorQ03431PTH1RHomo sapiens (Human)593
43772Relaxin receptor 1Q9HBX9RXFP1Homo sapiens (Human)757
43775Relaxin receptor 2Q8WXD0RXFP2Homo sapiens (Human)754
43773Vasopressin V1b receptorP47901AVPR1BHomo sapiens (Human)424

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