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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

NameDABDMA
Molecular formulaC22H25NO
IUPAC name6-(diethylamino)-1,1-diphenylhex-4-yn-2-one
Molecular weight319.448
Hydrogen bond acceptor2
Hydrogen bond donor0
XlogP4.2
SynonymsBDBM82373
diphenylacetoxybutynyl dimethylamine
Inchi KeyCHKZTUMZZKNFAZ-UHFFFAOYSA-N
Inchi IDInChI=1S/C22H25NO/c1-3-23(4-2)18-12-11-17-21(24)22(19-13-7-5-8-14-19)20-15-9-6-10-16-20/h5-10,13-16,22H,3-4,17-18H2,1-2H3
PubChem CID57339628
ChEMBLN/A
IUPHARN/A
BindingDB82373
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
42085Muscarinic acetylcholine receptor M1P08482Chrm1Rattus norvegicus (Rat)460
42084Muscarinic acetylcholine receptor M2P10980Chrm2Rattus norvegicus (Rat)466
42083Muscarinic acetylcholine receptor M3P08483Chrm3Rattus norvegicus (Rat)589
42086Muscarinic acetylcholine receptor M4P17200CHRM4Gallus gallus (Chicken)490

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