General Information of the Compound
| Compound ID |
CP0375977
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| Compound Name |
(2E,6E)-2,6-bis[(2-bromophenyl)methylidene]cyclohexan-1-one
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| Structure |
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| Formula |
C20H16Br2O
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| Molecular Weight |
432.155
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| Canonical SMILES |
Brc1ccccc1\C=C1/CCC\C(=C/c2ccccc2Br)C1=O
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| InChI |
InChI=1S/C20H16Br2O/c21-18-10-3-1-6-14(18)12-16-8-5-9-17(20(16)23)13-15-7-2-4-11-19(15)22/h1-4,6-7,10-13H,5,8-9H2/b16-12+,17-13+
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| InChIKey |
IYUMKWYJTLIPIV-UNZYHPAISA-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