General Information of the Compound
| Compound ID |
CP0433629
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| Compound Name |
(4-methylpiperazin-1-yl)-[4-(morpholin-4-ylmethyl)phenyl]methanone
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| Structure |
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| Formula |
C17H25N3O2
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| Molecular Weight |
303.406
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| Canonical SMILES |
CN1CCN(CC1)C(=O)c1ccc(CN2CCOCC2)cc1
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| InChI |
InChI=1S/C17H25N3O2/c1-18-6-8-20(9-7-18)17(21)16-4-2-15(3-5-16)14-19-10-12-22-13-11-19/h2-5H,6-14H2,1H3
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| InChIKey |
LWBZVRUFDRCWEP-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