General Information of the Compound
| Compound ID |
CP0448594
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| Compound Name |
2-[(Benzyl-hydroxy-amino)-methylene]-3,4-dihydro-2H-naphthalen-1-one
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| Structure |
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| Formula |
C18H17NO2
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| Molecular Weight |
279.339
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| Canonical SMILES |
ON(Cc1ccccc1)\C=C1\CCc2ccccc2C1=O
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| InChI |
InChI=1S/C18H17NO2/c20-18-16(11-10-15-8-4-5-9-17(15)18)13-19(21)12-14-6-2-1-3-7-14/h1-9,13,21H,10-12H2/b16-13-
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| InChIKey |
YWDAIBWTUWDDEM-SSZFMOIBSA-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