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Ligand

NameCHEMBL3342856
Molecular formulaC19H29N3O3
IUPAC name3-[[4-(2-methoxyphenyl)piperazin-1-yl]methyl]-1,4-dioxa-8-azaspiro[4.5]decane
Molecular weight347.459
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP1.4
SynonymsBDBM50099440
Inchi KeyBQGYIRQTWGRQRL-UHFFFAOYSA-N
Inchi IDInChI=1S/C19H29N3O3/c1-23-18-5-3-2-4-17(18)22-12-10-21(11-13-22)14-16-15-24-19(25-16)6-8-20-9-7-19/h2-5,16,20H,6-15H2,1H3
PubChem CID118716703
ChEMBLCHEMBL3342856
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: 7
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
4428475-hydroxytryptamine receptor 1AP08908HTR1AHomo sapiens (Human)422
442842Alpha-1A adrenergic receptorP43140Adra1aRattus norvegicus (Rat)466
442848Alpha-1A adrenergic receptorP35348ADRA1AHomo sapiens (Human)466
442844Alpha-1B adrenergic receptorP15823Adra1bRattus norvegicus (Rat)515
442846Alpha-1B adrenergic receptorP35368ADRA1BHomo sapiens (Human)520
442843Alpha-1D adrenergic receptorP23944Adra1dRattus norvegicus (Rat)561
442845Alpha-1D adrenergic receptorP25100ADRA1DHomo sapiens (Human)572

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