General Information of the Compound
| Compound ID |
CP0450609
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| Compound Name |
CAS_116679-83-5
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| Synonyms |
4-fluorohexahydrosiladifenidol
p-F-HHSiD
p-pluorohexahydrosiladyphenidol
pFHHSiD
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| Structure |
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| Formula |
C20H32FNOSi
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| Molecular Weight |
349.566
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| Canonical SMILES |
O[Si](CCCN1CCCCC1)(C1CCCCC1)c1ccc(F)cc1
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| InChI |
InChI=1S/C20H32FNOSi/c21-18-10-12-20(13-11-18)24(23,19-8-3-1-4-9-19)17-7-16-22-14-5-2-6-15-22/h10-13,19,23H,1-9,14-17H2
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| InChIKey |
ZNSZQJHTFRQUPD-UHFFFAOYSA-N
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| CAS |
116679-83-5
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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
Clinical Information about the Compound