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BioLiP E. coli GLASS GPCR-HGmod GPCR-RD GPCR-EXP Tara-3D TM-fold DECOYS POTENTIAL RW/RWplus EvoEF HPSF THE-DB ADDRESS Alpaca-Antibody CASP7 CASP8 CASP9 CASP10 CASP11 CASP12 CASP13 CASP14

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Ligand

NameCHEMBL201525
Molecular formulaC18H21N
IUPAC name11-methyl-11-azatricyclo[12.4.0.03,8]octadeca-1(18),3,5,7,14,16-hexaene
Molecular weight251.373
Hydrogen bond acceptor1
Hydrogen bond donor0
XlogP4.6
Synonyms11-methyl-11-aza-tricyclo[12.4.0.03,8]octadeca-1(18),3(8),4,6,14,16-hexaene
BDBM50180925
ZINC13679813
7-methyl-5,6,7,8,9,14-hexahydrodibenzo[d,g]azecine
Inchi KeyBXOLXXSMCLYDNG-UHFFFAOYSA-N
Inchi IDInChI=1S/C18H21N/c1-19-12-10-15-6-2-4-8-17(15)14-18-9-5-3-7-16(18)11-13-19/h2-9H,10-14H2,1H3
PubChem CID5249956
ChEMBLCHEMBL201525
IUPHARN/A
BindingDB50180925
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: 6
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
352835-hydroxytryptamine receptor 2AP50129HTR2ASus scrofa (Pig)470
35282D(1A) dopamine receptorP21728DRD1Homo sapiens (Human)446
35281D(1B) dopamine receptorP21918DRD5Homo sapiens (Human)477
35278D(2) dopamine receptorP14416DRD2Homo sapiens (Human)443
35279D(3) dopamine receptorP35462DRD3Homo sapiens (Human)400
35280D(4) dopamine receptorP21917DRD4Homo sapiens (Human)467

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