General Information of the Compound
| Compound ID |
CP0383904
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| Compound Name |
4-Octyloxy-3-phenylsulfonylfuroxan
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| Structure |
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| Formula |
C16H22N2O5S
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| Molecular Weight |
354.428
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| Canonical SMILES |
CCCCCCCCOc1no[n+]([O-])c1S(=O)(=O)c1ccccc1
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| InChI |
InChI=1S/C16H22N2O5S/c1-2-3-4-5-6-10-13-22-15-16(18(19)23-17-15)24(20,21)14-11-8-7-9-12-14/h7-9,11-12H,2-6,10,13H2,1H3
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| InChIKey |
YKZYJJZHFJGMJT-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
Protein ID: PT01546, ATP-dependent translocase ABCB1
Protein ID: PT02516, Multidrug resistance-associated protein 1