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Ligand

NameNSC157267
Molecular formulaC13H16ClNO2
IUPAC name(E)-3-(4-chlorophenyl)-N-(1-hydroxybutan-2-yl)prop-2-enamide
Molecular weight253.726
Hydrogen bond acceptor2
Hydrogen bond donor2
XlogP2.3
SynonymsAKOS005832485
NSC-157267
(E)-3-(4-chlorophenyl)-N-(1-hydroxybutan-2-yl)prop-2-enamide
AC1O3OFM
CHEMBL3884786
Inchi KeyPRRQIMZFWXXIRY-VMPITWQZSA-N
Inchi IDInChI=1S/C13H16ClNO2/c1-2-12(9-16)15-13(17)8-5-10-3-6-11(14)7-4-10/h3-8,12,16H,2,9H2,1H3,(H,15,17)/b8-5+
PubChem CID6310476
ChEMBLCHEMBL3884786
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: 54
Page:  / 3 

GLASS IDNameUniProtGeneSpeciesLength
5431345-hydroxytryptamine receptor 1AP08908HTR1AHomo sapiens (Human)422
5431685-hydroxytryptamine receptor 1BP28564Htr1bRattus norvegicus (Rat)386
5431595-hydroxytryptamine receptor 2AP28223HTR2AHomo sapiens (Human)471
5431425-hydroxytryptamine receptor 2BP41595HTR2BHomo sapiens (Human)481
5431165-hydroxytryptamine receptor 2CP28335HTR2CHomo sapiens (Human)458
5431405-hydroxytryptamine receptor 5AP47898HTR5AHomo sapiens (Human)357
5431185-hydroxytryptamine receptor 6P50406HTR6Homo sapiens (Human)440
5431245-hydroxytryptamine receptor 7P34969HTR7Homo sapiens (Human)479
543137Adenosine receptor A1P30542ADORA1Homo sapiens (Human)326
543119Adenosine receptor A2aP29274ADORA2AHomo sapiens (Human)412
543122Adenosine receptor A3P0DMS8ADORA3Homo sapiens (Human)318
543125B2 bradykinin receptorP30411BDKRB2Homo sapiens (Human)391
543126Beta-1 adrenergic receptorP08588ADRB1Homo sapiens (Human)477
543130Beta-2 adrenergic receptorP07550ADRB2Homo sapiens (Human)413
543133C-C chemokine receptor type 1P32246CCR1Homo sapiens (Human)355
543161C-X-C chemokine receptor type 2P25025CXCR2Homo sapiens (Human)360
543153Calcitonin gene-related peptide type 1 receptorQ16602CALCRLHomo sapiens (Human)461
543121Cannabinoid receptor 1P21554CNR1Homo sapiens (Human)472
543154Cholecystokinin receptor type AP32238CCKARHomo sapiens (Human)428
543136D(1A) dopamine receptorP21728DRD1Homo sapiens (Human)446

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