General Information of the Compound
| Compound ID |
CP0875307
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| Compound Name |
(E)-3',5'-Dimethoxy-4-(2-triethylammoniumethyloxy)stilbene Iodide
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| Structure |
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| Formula |
C24H34INO3
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| Molecular Weight |
511.444
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| Canonical SMILES |
CC[N+](CC)(CC)CCOc1ccc(/C=C/c2cc(OC)cc(OC)c2)cc1.[I-]
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| InChI |
InChI=1S/C24H34NO3.HI/c1-6-25(7-2,8-3)15-16-28-22-13-11-20(12-14-22)9-10-21-17-23(26-4)19-24(18-21)27-5;/h9-14,17-19H,6-8,15-16H2,1-5H3;1H/q+1;/p-1/b10-9+;
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| InChIKey |
ZQOOZRXNZQVSIV-RRABGKBLSA-M
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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