General Information of the Compound
| Compound ID |
CP0853900
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| Compound Name |
(E)-4-(8-Triphenylphosphoniumoctyloxy)stilbene Iodide
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| Structure |
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| Formula |
C40H42IOP
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| Molecular Weight |
696.653
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| Canonical SMILES |
C(=C/c1ccc(OCCCCCCCC[P+](c2ccccc2)(c2ccccc2)c2ccccc2)cc1)\c1ccccc1.[I-]
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| InChI |
InChI=1S/C40H42OP.HI/c1(3-17-33-41-37-31-29-36(30-32-37)28-27-35-19-9-5-10-20-35)2-4-18-34-42(38-21-11-6-12-22-38,39-23-13-7-14-24-39)40-25-15-8-16-26-40;/h5-16,19-32H,1-4,17-18,33-34H2;1H/q+1;/p-1/b28-27+;
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| InChIKey |
XXXQFBDSNLMKFH-RXQWRGDBSA-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