General Information of the Compound
| Compound ID |
CP0067553
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| Compound Name |
(1E,4E)-1,5-Diphenyl-penta-1,4-dien-3-one
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| Structure |
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| Formula |
C17H14O
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| Molecular Weight |
234.298
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| Canonical SMILES |
O=C(\C=C\c1ccccc1)/C=C/c1ccccc1
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| InChI |
InChI=1S/C17H14O/c18-17(13-11-15-7-3-1-4-8-15)14-12-16-9-5-2-6-10-16/h1-14H/b13-11+,14-12+
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| InChIKey |
WMKGGPCROCCUDY-PHEQNACWSA-N
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| CAS |
35225-79-7
538-58-9
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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
Protein ID: PT06109, Geminin
Protein ID: PT01039, Tissue factor