General Information of the Compound
| Compound ID |
CP0406897
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| Compound Name |
2-(benzyloxy)-1-(4-(2-chloro-4-fluorophenyl)piperazin-1-yl)ethanone
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| Structure |
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| Formula |
C19H20ClFN2O2
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| Molecular Weight |
362.832
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| Canonical SMILES |
Fc1ccc(N2CCN(CC2)C(=O)COCc2ccccc2)c(Cl)c1
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| InChI |
InChI=1S/C19H20ClFN2O2/c20-17-12-16(21)6-7-18(17)22-8-10-23(11-9-22)19(24)14-25-13-15-4-2-1-3-5-15/h1-7,12H,8-11,13-14H2
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| InChIKey |
ZRCPJFACEZIVJT-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