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Ligand

NameCHEMBL362358
Molecular formulaC20H27N6O5+
IUPAC name1-[4-(2-carbamoylpyrrolidin-1-yl)-4-oxo-3-[(5-oxopyrrolidine-2-carbonyl)amino]butyl]pyridin-1-ium-3-carboxamide
Molecular weight431.473
Hydrogen bond acceptor5
Hydrogen bond donor4
XlogP-2.7
Synonyms1-[3-(5-Oxo-2-pyrrolidinylcarbonylamino)-4-oxo-4-[2-(aminocarbonyl)pyrrolizino]butyl]-3-(aminocarbonyl)pyridinium
BDBM50156179
3-carbamoyl-1-{4-(2-carbamoyl-pyrrolidin-1-yl)-4-oxo-3-[(5-oxo-pyrrolidine-2-carbonyl)-amino]-butyl}-pyridinium;
Inchi KeyQUILMVVCZFJPCG-UHFFFAOYSA-O
Inchi IDInChI=1S/C20H26N6O5/c21-17(28)12-3-1-8-25(11-12)10-7-14(24-19(30)13-5-6-16(27)23-13)20(31)26-9-2-4-15(26)18(22)29/h1,3,8,11,13-15H,2,4-7,9-10H2,(H5-,21,22,23,24,27,28,29,30)/p+1
PubChem CID44398430
ChEMBLN/A
IUPHARN/A
BindingDB50156179
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
287020Thyrotropin-releasing hormone receptorQ01717TrhrRattus norvegicus (Rat)412

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