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Ligand

NameSCHEMBL6924756
Molecular formulaC26H25N7O
IUPAC name[5-methyl-2-(triazol-2-yl)phenyl]-[2-(4-phenylpyrimidin-2-yl)-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrol-5-yl]methanone
Molecular weight451.534
Hydrogen bond acceptor6
Hydrogen bond donor0
XlogP3.9
SynonymsUS8653263, 127
CHEMBL3649088
BDBM118474
Inchi KeyABKKOOXXHVYISB-UHFFFAOYSA-N
Inchi IDInChI=1S/C26H25N7O/c1-18-7-8-24(33-28-11-12-29-33)22(13-18)25(34)31-14-20-16-32(17-21(20)15-31)26-27-10-9-23(30-26)19-5-3-2-4-6-19/h2-13,20-21H,14-17H2,1H3
PubChem CID69939202
ChEMBLCHEMBL3649088
IUPHARN/A
BindingDB118474
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: 2
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
926Orexin receptor type 1O43613HCRTR1Homo sapiens (Human)425
927Orexin receptor type 2O43614HCRTR2Homo sapiens (Human)444

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