General Information of the Compound
| Compound ID |
CP0508066
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| Compound Name |
2-(benzyloxy)-1-(4-(3-chlorophenyl)piperazin-1-yl)ethanone
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| Structure |
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| Formula |
C19H21ClN2O2
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| Molecular Weight |
344.842
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| Canonical SMILES |
Clc1cccc(c1)N1CCN(CC1)C(=O)COCc1ccccc1
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| InChI |
InChI=1S/C19H21ClN2O2/c20-17-7-4-8-18(13-17)21-9-11-22(12-10-21)19(23)15-24-14-16-5-2-1-3-6-16/h1-8,13H,9-12,14-15H2
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| InChIKey |
CLYGEPUTTXMDBI-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