General Information of the Compound
| Compound ID |
CP0469762
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| Compound Name |
US9000044, 47
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| Structure |
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| Formula |
C24H24FNO4S
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| Molecular Weight |
441.524
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| Canonical SMILES |
Cc1c(CC(O)=O)cc2ccc(F)cc2c1-c1ccc(cc1)S(=O)(=O)N1CCCCC1
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| InChI |
InChI=1S/C24H24FNO4S/c1-16-19(14-23(27)28)13-18-5-8-20(25)15-22(18)24(16)17-6-9-21(10-7-17)31(29,30)26-11-3-2-4-12-26/h5-10,13,15H,2-4,11-12,14H2,1H3,(H,27,28)
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| InChIKey |
DVPGAWMDHGMNAE-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