General Information of the Compound
| Compound ID |
CP0433999
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| Compound Name |
3-(Benzyl-hydroxy-amino)-1-(2,6-dichloro-phenyl)-propenone
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| Structure |
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| Formula |
C16H13Cl2NO2
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| Molecular Weight |
322.191
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| Canonical SMILES |
ON(Cc1ccccc1)\C=C/C(=O)c1c(Cl)cccc1Cl
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| InChI |
InChI=1S/C16H13Cl2NO2/c17-13-7-4-8-14(18)16(13)15(20)9-10-19(21)11-12-5-2-1-3-6-12/h1-10,21H,11H2/b10-9-
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| InChIKey |
SUNOVYZCRWJEJP-KTKRTIGZSA-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