General Information of the Compound
| Compound ID |
CP0492508
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| Compound Name |
US8912224, 366
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| Structure |
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| Formula |
C24H20FN3O5S
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| Molecular Weight |
481.505
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| Canonical SMILES |
COc1c(F)cccc1C1CCc2cc(Oc3ncc(s3)C(=O)NCc3ccno3)ccc2O1
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| InChI |
InChI=1S/C24H20FN3O5S/c1-30-22-17(3-2-4-18(22)25)20-7-5-14-11-15(6-8-19(14)32-20)31-24-27-13-21(34-24)23(29)26-12-16-9-10-28-33-16/h2-4,6,8-11,13,20H,5,7,12H2,1H3,(H,26,29)
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| InChIKey |
GQOPFSJBNKXGAY-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