General Information of the Compound
| Compound ID |
CP0480774
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| Compound Name |
1-[4-[2-(5-methyl-1-naphthalen-2-ylpyrazol-3-yl)oxyethyl]piperazin-1-yl]ethanone
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| Structure |
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| Formula |
C22H26N4O2
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| Molecular Weight |
378.476
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| Canonical SMILES |
CC(=O)N1CCN(CCOc2cc(C)n(n2)-c2ccc3ccccc3c2)CC1
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| InChI |
InChI=1S/C22H26N4O2/c1-17-15-22(28-14-13-24-9-11-25(12-10-24)18(2)27)23-26(17)21-8-7-19-5-3-4-6-20(19)16-21/h3-8,15-16H,9-14H2,1-2H3
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| InChIKey |
IUAPCWFBCCDPBP-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