General Information of the Compound
| Compound ID |
CP0565038
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| Compound Name |
US9067935, 108
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| Structure |
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| Formula |
C26H24F3N3O5S
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| Molecular Weight |
547.555
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| Canonical SMILES |
COC(=O)c1ccc(cc1)S(=O)(=O)N(Cc1ccc(OC(F)(F)F)cc1)c1nc2ccccn2c1C(C)C
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| InChI |
InChI=1S/C26H24F3N3O5S/c1-17(2)23-24(30-22-6-4-5-15-31(22)23)32(16-18-7-11-20(12-8-18)37-26(27,28)29)38(34,35)21-13-9-19(10-14-21)25(33)36-3/h4-15,17H,16H2,1-3H3
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| InChIKey |
QUDWZOCWPMOJDB-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