General Information of the Compound
| Compound ID |
CP0467396
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| Compound Name |
(E)-3-(2,4-dimethylphenyl)-1-phenylprop-2-en-1-one
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| Structure |
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| Formula |
C17H16O
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| Molecular Weight |
236.314
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| Canonical SMILES |
Cc1ccc(\C=C\C(=O)c2ccccc2)c(C)c1
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| InChI |
InChI=1S/C17H16O/c1-13-8-9-15(14(2)12-13)10-11-17(18)16-6-4-3-5-7-16/h3-12H,1-2H3/b11-10+
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| InChIKey |
NUUDDTFQVVMRLG-ZHACJKMWSA-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