General Information of the Compound
| Compound ID |
CP0955628
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| Compound Name |
(E)-4-(5-Triphenylphosphoniumpentyloxy)stilbene Iodide
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| Structure |
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| Formula |
C37H36IOP
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| Molecular Weight |
654.572
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| Canonical SMILES |
C(=C/c1ccc(OCCCCC[P+](c2ccccc2)(c2ccccc2)c2ccccc2)cc1)\c1ccccc1.[I-]
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| InChI |
InChI=1S/C37H36OP.HI/c1-6-16-32(17-7-1)24-25-33-26-28-34(29-27-33)38-30-14-5-15-31-39(35-18-8-2-9-19-35,36-20-10-3-11-21-36)37-22-12-4-13-23-37;/h1-4,6-13,16-29H,5,14-15,30-31H2;1H/q+1;/p-1/b25-24+;
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| InChIKey |
CBQLKOLDQYBDLK-QREUMGABSA-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