General Information of the Compound
| Compound ID |
CP0417673
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| Compound Name |
(2E,4E)-1-(2-hydroxyphenyl)-5-(4-nitrophenyl)penta-2,4-dien-1-one
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| Structure |
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| Formula |
C17H13NO4
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| Molecular Weight |
295.294
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| Canonical SMILES |
Oc1ccccc1C(=O)\C=C\C=C\c1ccc(cc1)[N+]([O-])=O
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| InChI |
InChI=1S/C17H13NO4/c19-16(15-6-2-4-8-17(15)20)7-3-1-5-13-9-11-14(12-10-13)18(21)22/h1-12,20H/b5-1+,7-3+
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| InChIKey |
CMFVUYHJKCVYAG-JGOQQPJWSA-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