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Ligand

NameSCHEMBL1671969
Molecular formulaC26H33N7O
IUPAC name[2-(4-methyl-6-propan-2-ylpyrimidin-2-yl)-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrol-5-yl]-[5-propan-2-yl-2-(triazol-2-yl)phenyl]methanone
Molecular weight459.598
Hydrogen bond acceptor6
Hydrogen bond donor0
XlogP4.5
SynonymsUS8653263, 300
CHEMBL3652447
BDBM118647
Inchi KeyABWMSPCTSXQCBA-UHFFFAOYSA-N
Inchi IDInChI=1S/C26H33N7O/c1-16(2)19-6-7-24(33-27-8-9-28-33)22(11-19)25(34)31-12-20-14-32(15-21(20)13-31)26-29-18(5)10-23(30-26)17(3)4/h6-11,16-17,20-21H,12-15H2,1-5H3
PubChem CID67116652
ChEMBLCHEMBL3652447
IUPHARN/A
BindingDB118647
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
1240Orexin receptor type 1O43613HCRTR1Homo sapiens (Human)425
1241Orexin receptor type 2O43614HCRTR2Homo sapiens (Human)444

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