General Information of the Compound
| Compound ID |
CP0911936
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| Compound Name |
3-(Benzyl-hydroxy-amino)-1-(4-fluoro-phenyl)-but-2-en-1-one
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| Structure |
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| Formula |
C17H16FNO2
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| Molecular Weight |
285.318
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| Canonical SMILES |
C/C(=C/C(=O)c1ccc(F)cc1)N(O)Cc1ccccc1
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| InChI |
InChI=1S/C17H16FNO2/c1-13(19(21)12-14-5-3-2-4-6-14)11-17(20)15-7-9-16(18)10-8-15/h2-11,21H,12H2,1H3/b13-11-
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| InChIKey |
JPSKTAJUFHZZII-QBFSEMIESA-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