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Ligand

NameCHEMBL493494
Molecular formulaC19H18BrN3O2
IUPAC name(3S,4R)-N-[(E)-1-(2-bromophenyl)ethylideneamino]-2-oxo-4-phenylpyrrolidine-3-carboxamide
Molecular weight400.276
Hydrogen bond acceptor3
Hydrogen bond donor2
XlogP3.6
SynonymsBDBM50412714
Inchi KeyAHFKNFTVRFWWJP-OPJNVNOGSA-N
Inchi IDInChI=1S/C19H18BrN3O2/c1-12(14-9-5-6-10-16(14)20)22-23-19(25)17-15(11-21-18(17)24)13-7-3-2-4-8-13/h2-10,15,17H,11H2,1H3,(H,21,24)(H,23,25)/b22-12+/t15-,17-/m0/s1
PubChem CID25108280
ChEMBLCHEMBL493494
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
5495Proteinase-activated receptor 2P55085F2RL1Homo sapiens (Human)397

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