General Information of the Compound
| Compound ID |
CP0511705
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| Compound Name |
1,10-bis-[3-[2-[4-(2-methoxyphenyl)piperazin-1-yl]-ethyl]phenoxy]decane
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| Structure |
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| Formula |
C48H66N4O4
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| Molecular Weight |
763.08
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| Canonical SMILES |
COc1ccccc1N1CCN(CCc2cccc(OCCCCCCCCCCOc3cccc(CCN4CCN(CC4)c4ccccc4OC)c3)c2)CC1
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| InChI |
InChI=1S/C48H66N4O4/c1-53-47-23-11-9-21-45(47)51-33-29-49(30-34-51)27-25-41-17-15-19-43(39-41)55-37-13-7-5-3-4-6-8-14-38-56-44-20-16-18-42(40-44)26-28-50-31-35-52(36-32-50)46-22-10-12-24-48(46)54-2/h9-12,15-24,39-40H,3-8,13-14,25-38H2,1-2H3
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| InChIKey |
CFWSAXZHOITROD-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