General Information of the Compound
| Compound ID |
CP0406711
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| Compound Name |
1-(1-Benzyl-piperidin-4-yl)-5-methyl-4-pyridin-2-yl-1,3-dihydro-imidazol-2-one
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| Structure |
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| Formula |
C21H24N4O
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| Molecular Weight |
348.45
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| Canonical SMILES |
Cc1c([nH]c(=O)n1C1CCN(Cc2ccccc2)CC1)-c1ccccn1
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| InChI |
InChI=1S/C21H24N4O/c1-16-20(19-9-5-6-12-22-19)23-21(26)25(16)18-10-13-24(14-11-18)15-17-7-3-2-4-8-17/h2-9,12,18H,10-11,13-15H2,1H3,(H,23,26)
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| InChIKey |
HCOQJKDXIVIYQF-UHFFFAOYSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound
Protein ID: PT01005, D(2) dopamine receptor
Protein ID: PT00943, D(3) dopamine receptor
Protein ID: PT01161, D(4) dopamine receptor