General Information of the Compound
| Compound ID |
CP0945632
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| Compound Name |
(E)-4-(6-Triphenylphosphoniumhexyloxy)stilbene Iodide
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| Structure |
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| Formula |
C38H38IOP
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| Molecular Weight |
668.599
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| Canonical SMILES |
C(=C/c1ccc(OCCCCCC[P+](c2ccccc2)(c2ccccc2)c2ccccc2)cc1)\c1ccccc1.[I-]
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| InChI |
InChI=1S/C38H38OP.HI/c1(15-31-39-35-29-27-34(28-30-35)26-25-33-17-7-3-8-18-33)2-16-32-40(36-19-9-4-10-20-36,37-21-11-5-12-22-37)38-23-13-6-14-24-38;/h3-14,17-30H,1-2,15-16,31-32H2;1H/q+1;/p-1/b26-25+;
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| InChIKey |
SJAKUNBAYWZRAM-BTKVJIOYSA-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