General Information of the Compound
| Compound ID |
CP0553379
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| Compound Name |
US9067871, 36
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| Structure |
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| Formula |
C23H26ClF2NO3
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| Molecular Weight |
437.914
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| Canonical SMILES |
CC(C)(C)OC(=O)NC1CCc2ccc(OC(F)F)cc2C1Cc1ccc(Cl)cc1
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| InChI |
InChI=1S/C23H26ClF2NO3/c1-23(2,3)30-22(28)27-20-11-7-15-6-10-17(29-21(25)26)13-18(15)19(20)12-14-4-8-16(24)9-5-14/h4-6,8-10,13,19-21H,7,11-12H2,1-3H3,(H,27,28)
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| InChIKey |
XQDWXUDIDYCQIB-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