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Ligand

NameCHEMBL116913
Molecular formulaC16H22ClN3O3
IUPAC name7-amino-6-chloro-10,13-dioxa-2,16-diazatricyclo[14.2.2.04,9]icosa-4,6,8-trien-3-one
Molecular weight339.82
Hydrogen bond acceptor5
Hydrogen bond donor2
XlogP1.3
SynonymsBDBM50122871
7-Amino-6-chloro-10,13-dioxa-2,16-diaza-tricyclo[14.2.2.0*4,9*]icosa-4,6,8-trien-3-one
Inchi KeyCEOCEXSTLLSYBV-UHFFFAOYSA-N
Inchi IDInChI=1S/C16H22ClN3O3/c17-13-9-12-15(10-14(13)18)23-8-7-22-6-5-20-3-1-11(2-4-20)19-16(12)21/h9-11H,1-8,18H2,(H,19,21)
PubChem CID11724799
ChEMBLCHEMBL116913
IUPHARN/A
BindingDB50122871
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
400935-hydroxytryptamine receptor 4Q62758Htr4Rattus norvegicus (Rat)406
40092D(2) dopamine receptorP61169Drd2Rattus norvegicus (Rat)444

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