General Information of the Compound
| Compound ID |
CP0557407
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| Compound Name |
2-[4-[2-(2-methylphenoxy)ethyl]piperazin-1-yl]-N-(1,3-thiazol-2-yl)acetamide
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| Structure |
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| Formula |
C18H24N4O2S
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| Molecular Weight |
360.483
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| Canonical SMILES |
Cc1ccccc1OCCN1CCN(CC(=O)Nc2nccs2)CC1
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| InChI |
InChI=1S/C18H24N4O2S/c1-15-4-2-3-5-16(15)24-12-11-21-7-9-22(10-8-21)14-17(23)20-18-19-6-13-25-18/h2-6,13H,7-12,14H2,1H3,(H,19,20,23)
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| InChIKey |
LEXKBMHKJKGXMI-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