General Information of the Compound
| Compound ID |
CP0554661
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| Compound Name |
US9249085, II(d)
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| Structure |
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| Formula |
C24H21F4NO3
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| Molecular Weight |
447.428
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| Canonical SMILES |
CC(C)OC(=O)COc1ccc(F)c(NCc2cc(ccc2F)-c2cccc(F)c2)c1F
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| InChI |
InChI=1S/C24H21F4NO3/c1-14(2)32-22(30)13-31-21-9-8-20(27)24(23(21)28)29-12-17-10-16(6-7-19(17)26)15-4-3-5-18(25)11-15/h3-11,14,29H,12-13H2,1-2H3
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| InChIKey |
IMCGRIOLDVEPTA-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