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Ligand

NameCHEMBL370700
Molecular formulaC19H25N6O5+
IUPAC name1-[3-(2-carbamoylpyrrolidin-1-yl)-3-oxo-2-[(5-oxopyrrolidine-2-carbonyl)amino]propyl]pyridin-1-ium-3-carboxamide
Molecular weight417.446
Hydrogen bond acceptor5
Hydrogen bond donor4
XlogP-3.0
SynonymsSCHEMBL1371623
1-[2-(5-Oxo-2-pyrrolidinylcarbonylamino)-3-oxo-3-[2-(aminocarbonyl)pyrrolizino]propyl]-3-(aminocarbonyl)pyridinium
BDBM50156181
3-carbamoyl-1-{3-(2-carbamoyl-pyrrolidin-1-yl)-3-oxo-2-[(5-oxo-pyrrolidine-2-carbonyl)-amino]-propyl}-pyridinium; Trifluoro-acetate
Inchi KeyFSAYHTLBOLVRDW-UHFFFAOYSA-O
Inchi IDInChI=1S/C19H24N6O5/c20-16(27)11-3-1-7-24(9-11)10-13(23-18(29)12-5-6-15(26)22-12)19(30)25-8-2-4-14(25)17(21)28/h1,3,7,9,12-14H,2,4-6,8,10H2,(H5-,20,21,22,23,26,27,28,29)/p+1
PubChem CID10387244
ChEMBLN/A
IUPHARN/A
BindingDB50156181
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
85926Thyrotropin-releasing hormone receptorQ01717TrhrRattus norvegicus (Rat)412

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