General Information of the Compound
| Compound ID |
CP0878665
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| Compound Name |
3-Amino-6-dimethylamino-9-phenylthioxanthylium Hexafluorophosphate
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| Structure |
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| Formula |
C23H23F6N2PS
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| Molecular Weight |
504.48
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| Canonical SMILES |
CN(C)c1ccc2c(-c3ccccc3)c3ccc(=[N+](C)C)cc-3sc2c1.F[P-](F)(F)(F)(F)F
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| InChI |
InChI=1S/C23H23N2S.F6P/c1-24(2)17-10-12-19-21(14-17)26-22-15-18(25(3)4)11-13-20(22)23(19)16-8-6-5-7-9-16;1-7(2,3,4,5)6/h5-15H,1-4H3;/q+1;-1
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| InChIKey |
SMLDXSPUMFXVCT-UHFFFAOYSA-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