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Ligand

NameCHEMBL388350
Molecular formulaC20H29N5O4
IUPAC name(2S)-1-[(2S)-2-[[(1S)-3-oxocyclopentanecarbonyl]amino]-3-(2-propan-2-yl-1H-imidazol-5-yl)propanoyl]pyrrolidine-2-carboxamide
Molecular weight403.483
Hydrogen bond acceptor5
Hydrogen bond donor3
XlogP-1.0
SynonymsBDBM50196455
(2S)-1-[(2S)-2-(1S)-3-oxocyclopentylcarboxamido]-3-(2-isopropyl-1H-imidazolyl)propanoyl]azalone-2-carboxamide
Inchi KeyHFMCVIZOMVYWSL-RCBQFDQVSA-N
Inchi IDInChI=1S/C20H29N5O4/c1-11(2)18-22-10-13(23-18)9-15(24-19(28)12-5-6-14(26)8-12)20(29)25-7-3-4-16(25)17(21)27/h10-12,15-16H,3-9H2,1-2H3,(H2,21,27)(H,22,23)(H,24,28)/t12-,15-,16-/m0/s1
PubChem CID44422110
ChEMBLCHEMBL388350
IUPHARN/A
BindingDB50196455
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
113578Thyrotropin-releasing hormone receptorP34981TRHRHomo sapiens (Human)398

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