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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

NameCHEMBL1946779
Molecular formulaC26H29NO3
IUPAC nameN-[(5,5-diphenyloxolan-2-yl)methyl]-2-(2-methoxyphenoxy)ethanamine
Molecular weight403.522
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP4.9
SynonymsCHEMBL1962769
BDBM50419722
Inchi KeyYZLCDNYSBSWVBY-UHFFFAOYSA-N
Inchi IDInChI=1S/C26H29NO3/c1-28-24-14-8-9-15-25(24)29-19-18-27-20-23-16-17-26(30-23,21-10-4-2-5-11-21)22-12-6-3-7-13-22/h2-15,23,27H,16-20H2,1H3
PubChem CID56946474
ChEMBLCHEMBL1962769
IUPHARN/A
BindingDB50419722
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
4230345-hydroxytryptamine receptor 1AP08908HTR1AHomo sapiens (Human)422
423033Alpha-1A adrenergic receptorP35348ADRA1AHomo sapiens (Human)466
423031Alpha-1B adrenergic receptorP35368ADRA1BHomo sapiens (Human)520
423032Alpha-1D adrenergic receptorP25100ADRA1DHomo sapiens (Human)572
533434Trace amine-associated receptor 1Q923Y8Taar1Mus musculus (Mouse)332
533435Trace amine-associated receptor 5Q5QD14Taar5Mus musculus (Mouse)337

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