General Information of the Compound
| Compound ID |
CP0386067
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| Compound Name |
1-[4-[[4-[4-[(4-acetylpiperazin-1-yl)methyl]phenyl]phenyl]methyl]piperazin-1-yl]ethanone
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| Structure |
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| Formula |
C26H34N4O2
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| Molecular Weight |
434.584
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| Canonical SMILES |
CC(=O)N1CCN(Cc2ccc(cc2)-c2ccc(CN3CCN(CC3)C(C)=O)cc2)CC1
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| InChI |
InChI=1S/C26H34N4O2/c1-21(31)29-15-11-27(12-16-29)19-23-3-7-25(8-4-23)26-9-5-24(6-10-26)20-28-13-17-30(18-14-28)22(2)32/h3-10H,11-20H2,1-2H3
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| InChIKey |
CJFGHABBIYKHNJ-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