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Ligand

NameCHEMBL382714
Molecular formulaC20H30N6O4
IUPAC name(2S)-N-[(2S)-3-(2-tert-butyl-1H-imidazol-5-yl)-1-[(2S)-2-carbamoylpyrrolidin-1-yl]-1-oxopropan-2-yl]-5-oxopyrrolidine-2-carboxamide
Molecular weight418.498
Hydrogen bond acceptor5
Hydrogen bond donor4
XlogP-0.8
Synonyms1-[3-[2-(tert-butyl)-1H-4-imidazolyl]-2-[5-oxo-(2S)-tetrahydro-1H-2-pyrrolylcarboxamido]-(2S)-propanoyl]-(2S)-tetrahydro-1H-2-pyrrolecarboxamide
BDBM50173821
Inchi KeyQHZBXEVAWYKZHF-IHRRRGAJSA-N
Inchi IDInChI=1S/C20H30N6O4/c1-20(2,3)19-22-10-11(23-19)9-13(25-17(29)12-6-7-15(27)24-12)18(30)26-8-4-5-14(26)16(21)28/h10,12-14H,4-9H2,1-3H3,(H2,21,28)(H,22,23)(H,24,27)(H,25,29)/t12-,13-,14-/m0/s1
PubChem CID11625898
ChEMBLCHEMBL382714
IUPHARN/A
BindingDB50173821
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
278824Thyrotropin-releasing hormone receptorQ01717TrhrRattus norvegicus (Rat)412

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