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Ligand

NameCHEMBL1669644
Molecular formulaC18H19N3O4
IUPAC nameN-(3-methoxyphenyl)-3-nitro-4-pyrrolidin-1-ylbenzamide
Molecular weight341.367
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP3.2
SynonymsMCULE-9076084842
ZINC4668240
AKOS002128955
N-(3-methoxyphenyl)-3-nitro-4-pyrrolidin-1-ylbenzamide
SR-01000578161
[ Show all ]
Inchi KeyBFRWUCIWGKGCBL-UHFFFAOYSA-N
Inchi IDInChI=1S/C18H19N3O4/c1-25-15-6-4-5-14(12-15)19-18(22)13-7-8-16(17(11-13)21(23)24)20-9-2-3-10-20/h4-8,11-12H,2-3,9-10H2,1H3,(H,19,22)
PubChem CID2943253
ChEMBLCHEMBL1669644
IUPHARN/A
BindingDB50336221
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
22593Trace amine-associated receptor 1Q923Y8Taar1Mus musculus (Mouse)332

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