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Ligand

NameCHEMBL11592
Molecular formulaC26H38N2O4
IUPAC name8-[4-[(5-methoxy-3,4-dihydro-2H-chromen-3-yl)-propylamino]butyl]-8-azaspiro[4.5]decane-7,9-dione
Molecular weight442.6
Hydrogen bond acceptor5
Hydrogen bond donor0
XlogP4.6
Synonyms138277-78-8
8-[4-[(5-methoxy-3,4-dihydro-2H-chromen-3-yl)-propylamino]butyl]-8-azaspiro[4.5]decane-7,9-dione
8-[4-[Propyl(5-methoxychroman-3-yl)amino]butyl]-8-azaspiro[4.5]decane-7,9-dione
8-[4-[[(3S)-5-methoxychroman-3-yl]-propyl-amino]butyl]-8-azaspiro[4.5]decane-7,9-dione
AC1L3TIS
[ Show all ]
Inchi KeyDLLULNTXJPATBC-UHFFFAOYSA-N
Inchi IDInChI=1S/C26H38N2O4/c1-3-13-27(20-16-21-22(31-2)9-8-10-23(21)32-19-20)14-6-7-15-28-24(29)17-26(18-25(28)30)11-4-5-12-26/h8-10,20H,3-7,11-19H2,1-2H3
PubChem CID121852
ChEMBLCHEMBL11592
IUPHARN/A
BindingDB82368
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: 12
Page:  / 1 

GLASS IDNameUniProtGeneSpeciesLength
630745-hydroxytryptamine receptor 1AP08908HTR1AHomo sapiens (Human)422
630785-hydroxytryptamine receptor 1AP19327Htr1aRattus norvegicus (Rat)422
630775-hydroxytryptamine receptor 1BP28564Htr1bRattus norvegicus (Rat)386
630815-hydroxytryptamine receptor 1BP28222HTR1BHomo sapiens (Human)390
630765-hydroxytryptamine receptor 2AQ75Z89HTR2ABos taurus (Bovine)470
630795-hydroxytryptamine receptor 2AP28223HTR2AHomo sapiens (Human)471
63083Alpha-1A adrenergic receptorP18130ADRA1ABos taurus (Bovine)466
63073Alpha-2A adrenergic receptorQ28838ADRA2ABos taurus (Bovine)452
63080D(1A) dopamine receptorP21728DRD1Homo sapiens (Human)446
63082D(1A) dopamine receptorQ95136DRD1Bos taurus (Bovine)446
63075D(2) dopamine receptorP20288DRD2Bos taurus (Bovine)444
63084D(2) dopamine receptorP14416DRD2Homo sapiens (Human)443

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