General Information of the Compound
| Compound ID |
CP0397364
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| Compound Name |
(4-methylphenyl)-[4-(2-phenoxyethyl)piperazin-1-yl]methanone
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| Structure |
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| Formula |
C20H24N2O2
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| Molecular Weight |
324.424
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| Canonical SMILES |
Cc1ccc(cc1)C(=O)N1CCN(CCOc2ccccc2)CC1
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| InChI |
InChI=1S/C20H24N2O2/c1-17-7-9-18(10-8-17)20(23)22-13-11-21(12-14-22)15-16-24-19-5-3-2-4-6-19/h2-10H,11-16H2,1H3
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| InChIKey |
HCJGBLHCMQGIDA-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