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Ligand

NameSMR000147833
Molecular formulaC18H14N6OS
IUPAC name4,6-diamino-8-imino-12-oxo-14-phenyl-9-thia-3,11-diazatricyclo[8.4.0.02,7]tetradeca-1(10),2(7),3,5-tetraene-5-carbonitrile
Molecular weight362.411
Hydrogen bond acceptor7
Hydrogen bond donor4
XlogP1.1
Synonymscid_5900673
STK551756
647830-20-4
MLS000556516
REGID_for_CID_5900673
[ Show all ]
Inchi KeyDKEHVXLGLYZRNF-UHFFFAOYSA-N
Inchi IDInChI=1S/C18H14N6OS/c19-7-10-14(20)13-15(24-16(10)21)12-9(8-4-2-1-3-5-8)6-11(25)23-18(12)26-17(13)22/h1-5,9,22H,6H2,(H,23,25)(H4,20,21,24)
PubChem CID3708288
ChEMBLCHEMBL1556915
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: 4
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
559187Galanin receptor type 3O60755GALR3Homo sapiens (Human)368
559186Glucagon-like peptide 1 receptorP43220GLP1RHomo sapiens (Human)463
559189Neuropeptide S receptorQ6W5P4NPSR1Homo sapiens (Human)371
559188Relaxin receptor 1Q9HBX9RXFP1Homo sapiens (Human)757

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