General Information of the Compound
| Compound ID |
CP0379803
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| Compound Name |
US9365558, 13
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| Structure |
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| Formula |
C25H24F6N2O5S
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| Molecular Weight |
578.531
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| Canonical SMILES |
Cc1ccc(cc1)C1=C(C(=O)NS(C)(=O)=O)C(=O)N[C@@](C1)(c1ccc(OCCCC(F)(F)F)cc1)C(F)(F)F
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| InChI |
InChI=1S/C25H24F6N2O5S/c1-15-4-6-16(7-5-15)19-14-23(25(29,30)31,32-21(34)20(19)22(35)33-39(2,36)37)17-8-10-18(11-9-17)38-13-3-12-24(26,27)28/h4-11H,3,12-14H2,1-2H3,(H,32,34)(H,33,35)/t23-/m0/s1
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| InChIKey |
URCBIDOJNYANFF-QHCPKHFHSA-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