General Information of the Compound
| Compound ID |
CP0495368
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| Compound Name |
US9434711, 763
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| Structure |
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| Formula |
C22H24F3NO4S2
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| Molecular Weight |
487.565
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| Canonical SMILES |
Cc1c(sc2ccccc12)N(Cc1cccc(OC(F)(F)F)c1)S(=O)(=O)CCC(C)(C)O
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| InChI |
InChI=1S/C22H24F3NO4S2/c1-15-18-9-4-5-10-19(18)31-20(15)26(32(28,29)12-11-21(2,3)27)14-16-7-6-8-17(13-16)30-22(23,24)25/h4-10,13,27H,11-12,14H2,1-3H3
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| InChIKey |
HDTINRYJDRPECY-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