General Information of the Compound
| Compound ID |
CP0497776
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| Compound Name |
1-(4-Fluoro-phenyl)-3-(hydroxy-naphthalen-2-ylmethyl-amino)-propenone
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| Structure |
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| Formula |
C20H16FNO2
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| Molecular Weight |
321.351
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| Canonical SMILES |
ON(Cc1ccc2ccccc2c1)\C=C/C(=O)c1ccc(F)cc1
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| InChI |
InChI=1S/C20H16FNO2/c21-19-9-7-17(8-10-19)20(23)11-12-22(24)14-15-5-6-16-3-1-2-4-18(16)13-15/h1-13,24H,14H2/b12-11-
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| InChIKey |
BXAZEIUQKBZWHS-QXMHVHEDSA-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