General Information of the Compound
| Compound ID |
CP0424864
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| Compound Name |
1,1,1,3,3,3-hexafluoro-2-(4-(phenylsulfonyl)-3,4-dihydro-2H-benzo[b][1,4]oxazin-7-yl)propan-2-ol
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| Structure |
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| Formula |
C17H13F6NO4S
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| Molecular Weight |
441.349
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| Canonical SMILES |
OC(c1ccc2N(CCOc2c1)S(=O)(=O)c1ccccc1)(C(F)(F)F)C(F)(F)F
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| InChI |
InChI=1S/C17H13F6NO4S/c18-16(19,20)15(25,17(21,22)23)11-6-7-13-14(10-11)28-9-8-24(13)29(26,27)12-4-2-1-3-5-12/h1-7,10,25H,8-9H2
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| InChIKey |
RSBNGIIBGHODNQ-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