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Ligand

NameCHEMBL3342852
Molecular formulaC19H28N2O3S
IUPAC name1-(1,4-dioxa-8-thiaspiro[4.5]decan-3-ylmethyl)-4-(2-methoxyphenyl)piperazine
Molecular weight364.504
Hydrogen bond acceptor6
Hydrogen bond donor0
XlogP2.5
SynonymsBDBM50099435
Inchi KeyAKODHNGEOUFORT-UHFFFAOYSA-N
Inchi IDInChI=1S/C19H28N2O3S/c1-22-18-5-3-2-4-17(18)21-10-8-20(9-11-21)14-16-15-23-19(24-16)6-12-25-13-7-19/h2-5,16H,6-15H2,1H3
PubChem CID118716698
ChEMBLCHEMBL3342852
IUPHARN/A
BindingDB50099435
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
4420205-hydroxytryptamine receptor 1AP08908HTR1AHomo sapiens (Human)422
442021Alpha-1A adrenergic receptorP35348ADRA1AHomo sapiens (Human)466
442022Alpha-1A adrenergic receptorP43140Adra1aRattus norvegicus (Rat)466
442019Alpha-1B adrenergic receptorP35368ADRA1BHomo sapiens (Human)520
442023Alpha-1B adrenergic receptorP15823Adra1bRattus norvegicus (Rat)515
442018Alpha-1D adrenergic receptorP25100ADRA1DHomo sapiens (Human)572
442024Alpha-1D adrenergic receptorP23944Adra1dRattus norvegicus (Rat)561

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