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Ligand

Namemethyl 4-{4-[(4-bromophenyl)sulfonyl]piperazino}-3-nitrobenzenecarboxylate
Molecular formulaC18H18BrN3O6S
IUPAC namemethyl 4-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-3-nitrobenzoate
Molecular weight484.321
Hydrogen bond acceptor8
Hydrogen bond donor0
XlogP3.0
SynonymsKS-00003G89
Oprea1_416201
AC1NEBE4
methyl 4-[4-(4-bromophenyl)sulfonylpiperazin-1-yl]-3-nitrobenzoate
ZINC8670425
[ Show all ]
Inchi KeyAGUGPKUQSAPRGB-UHFFFAOYSA-N
Inchi IDInChI=1S/C18H18BrN3O6S/c1-28-18(23)13-2-7-16(17(12-13)22(24)25)20-8-10-21(11-9-20)29(26,27)15-5-3-14(19)4-6-15/h2-7,12H,8-11H2,1H3
PubChem CID4639593
ChEMBLCHEMBL1587185
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
5213Glucagon-like peptide 1 receptorP43220GLP1RHomo sapiens (Human)463

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