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Ligand

NameCHEMBL1221545
Molecular formulaC25H31N3O3S
IUPAC nameN-[4-[4-(2-methoxyphenyl)piperazin-1-yl]butyl]naphthalene-2-sulfonamide
Molecular weight453.601
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP4.5
SynonymsN-(4-(4-(2-methoxyphenyl)piperazin-1-yl)butyl)naphthalene-2-sulfonamide
BDBM50324890
Inchi KeyAUMIZIKCBYPWJM-UHFFFAOYSA-N
Inchi IDInChI=1S/C25H31N3O3S/c1-31-25-11-5-4-10-24(25)28-18-16-27(17-19-28)15-7-6-14-26-32(29,30)23-13-12-21-8-2-3-9-22(21)20-23/h2-5,8-13,20,26H,6-7,14-19H2,1H3
PubChem CID49864336
ChEMBLCHEMBL1221545
IUPHARN/A
BindingDB50324890
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
147795-hydroxytryptamine receptor 1AP08908HTR1AHomo sapiens (Human)422
14778Alpha-2A adrenergic receptorP08913ADRA2AHomo sapiens (Human)450
14776D(2) dopamine receptorP14416DRD2Homo sapiens (Human)443
14777D(3) dopamine receptorP19020Drd3Rattus norvegicus (Rat)446

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