General Information of the Compound
| Compound ID |
CP0374110
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| Compound Name |
3-methyl-6-(piperazin-1-yl)-2-(o-tolyloxymethyl)pyrimidin-4(3H)-one
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| Structure |
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| Formula |
C17H22N4O2
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| Molecular Weight |
314.389
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| Canonical SMILES |
Cc1ccccc1OCc1nc(cc(=O)n1C)N1CCNCC1
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| InChI |
InChI=1S/C17H22N4O2/c1-13-5-3-4-6-14(13)23-12-16-19-15(11-17(22)20(16)2)21-9-7-18-8-10-21/h3-6,11,18H,7-10,12H2,1-2H3
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| InChIKey |
OXUNVNUHRZYSAV-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