General Information of the Compound
| Compound ID |
CP0397358
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| Compound Name |
(2E,5E)-2,5-bis[(2-bromophenyl)methylidene]cyclopentan-1-one
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| Structure |
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| Formula |
C19H14Br2O
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| Molecular Weight |
418.128
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| Canonical SMILES |
Brc1ccccc1\C=C1/CC\C(=C/c2ccccc2Br)C1=O
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| InChI |
InChI=1S/C19H14Br2O/c20-17-7-3-1-5-13(17)11-15-9-10-16(19(15)22)12-14-6-2-4-8-18(14)21/h1-8,11-12H,9-10H2/b15-11+,16-12+
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| InChIKey |
VRZWMEJYNBXWDD-JOBJLJCHSA-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