General Information of the Compound
| Compound ID |
CP0518244
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| Compound Name |
US9035059, 6-18
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| Structure |
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| Formula |
C34H45FN2O2S
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| Molecular Weight |
564.811
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| Canonical SMILES |
CCCCCCCc1ccc(NS(=O)(=O)c2ccc3CN(CCc4ccc(cc4)C(C)(C)C)CCc3c2)c(F)c1
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| InChI |
InChI=1S/C34H45FN2O2S/c1-5-6-7-8-9-10-27-13-18-33(32(35)23-27)36-40(38,39)31-17-14-29-25-37(22-20-28(29)24-31)21-19-26-11-15-30(16-12-26)34(2,3)4/h11-18,23-24,36H,5-10,19-22,25H2,1-4H3
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| InChIKey |
SLPXPEHGGKZYFG-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