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Ligand

NameCHEMBL3600451
Molecular formulaC16H18ClN7O3
IUPAC nameN-[(2S)-1-[(2S)-2-carbamoylpyrrolidin-1-yl]-3-(4-chloro-1H-imidazol-5-yl)-1-oxopropan-2-yl]pyrazine-2-carboxamide
Molecular weight391.816
Hydrogen bond acceptor6
Hydrogen bond donor3
XlogP-0.5
SynonymsBDBM50109036
Inchi KeySFRZOLVQYBDMAO-JQWIXIFHSA-N
Inchi IDInChI=1S/C16H18ClN7O3/c17-13-9(21-8-22-13)6-10(23-15(26)11-7-19-3-4-20-11)16(27)24-5-1-2-12(24)14(18)25/h3-4,7-8,10,12H,1-2,5-6H2,(H2,18,25)(H,21,22)(H,23,26)/t10-,12-/m0/s1
PubChem CID122184251
ChEMBLCHEMBL3600451
IUPHARN/A
BindingDB50109036
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
501617Thyrotropin-releasing hormone receptorP21761TrhrMus musculus (Mouse)393

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