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Ligand

NameCID 56659615
Molecular formulaC28H26N4O3
IUPAC name2-(2,3-dihydro-1H-inden-2-yl)-1,3-dioxo-N-(2-phenylphenyl)-5,6,8,8a-tetrahydroimidazo[1,5-a]pyrazine-7-carboxamide
Molecular weight466.541
Hydrogen bond acceptor3
Hydrogen bond donor1
XlogP3.7
SynonymsN/A
Inchi KeyCARPNJBNMSFCHY-UHFFFAOYSA-N
Inchi IDInChI=1S/C28H26N4O3/c33-26-25-18-30(27(34)29-24-13-7-6-12-23(24)19-8-2-1-3-9-19)14-15-31(25)28(35)32(26)22-16-20-10-4-5-11-21(20)17-22/h1-13,22,25H,14-18H2,(H,29,34)
PubChem CID56659615
ChEMBLCHEMBL1808448
IUPHARN/A
BindingDBN/A
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
37462Smoothened homologQ99835SMOHomo sapiens (Human)787

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