BDBM50329951 CHEMBL1271815::N-(3-(4-(2,3-dimethylphenyl)piperazin-1-yl)propyl)-6-isopropyl-2-methylpyrimidine-4-carboxamide Hydrochloride

SMILES CC(C)c1cc(nc(C)n1)C(=O)NCCCN1CCN(CC1)c1cccc(C)c1C

InChI Key InChIKey=ADGQMFGFECWRRY-UHFFFAOYSA-N

Data  3 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50329951   

TargetSodium-dependent serotonin transporter(Homo sapiens (Human))
Green Cross Corporation

Curated by ChEMBL
LigandPNGBDBM50329951(CHEMBL1271815 | N-(3-(4-(2,3-dimethylphenyl)pipera...)
Show SMILES CC(C)c1cc(nc(C)n1)C(=O)NCCCN1CCN(CC1)c1cccc(C)c1C
Show InChI InChI=1S/C24H35N5O/c1-17(2)21-16-22(27-20(5)26-21)24(30)25-10-7-11-28-12-14-29(15-13-28)23-9-6-8-18(3)19(23)4/h6,8-9,16-17H,7,10-15H2,1-5H3,(H,25,30)
Affinity DataIC50: 1.21E+3nMAssay Description:Displacement of [3H]imipramine from human recombinant SERT receptor expressed in HEK293 cellsMore data for this Ligand-Target Pair
Target5-hydroxytryptamine receptor 2A(Homo sapiens (Human))
Green Cross Corporation

Curated by ChEMBL
LigandPNGBDBM50329951(CHEMBL1271815 | N-(3-(4-(2,3-dimethylphenyl)pipera...)
Show SMILES CC(C)c1cc(nc(C)n1)C(=O)NCCCN1CCN(CC1)c1cccc(C)c1C
Show InChI InChI=1S/C24H35N5O/c1-17(2)21-16-22(27-20(5)26-21)24(30)25-10-7-11-28-12-14-29(15-13-28)23-9-6-8-18(3)19(23)4/h6,8-9,16-17H,7,10-15H2,1-5H3,(H,25,30)
Affinity DataIC50: 490nMAssay Description:Displacement of [3H]ketanserin from human recombinant 5HT2A receptor expressed in CHO-K1 cellsMore data for this Ligand-Target Pair
Target5-hydroxytryptamine receptor 2C(Homo sapiens (Human))
Green Cross Corporation

Curated by ChEMBL
LigandPNGBDBM50329951(CHEMBL1271815 | N-(3-(4-(2,3-dimethylphenyl)pipera...)
Show SMILES CC(C)c1cc(nc(C)n1)C(=O)NCCCN1CCN(CC1)c1cccc(C)c1C
Show InChI InChI=1S/C24H35N5O/c1-17(2)21-16-22(27-20(5)26-21)24(30)25-10-7-11-28-12-14-29(15-13-28)23-9-6-8-18(3)19(23)4/h6,8-9,16-17H,7,10-15H2,1-5H3,(H,25,30)
Affinity DataIC50: 1.55E+3nMAssay Description:Displacement of [3H]mesulergine from human recombinant 5HT2C receptor expressed in CHO-K1 cellsMore data for this Ligand-Target Pair