General Information of the Compound
| Compound ID |
CP0566268
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| Compound Name |
US9428456, 1.329
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| Structure |
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| Formula |
C26H33F3N4O2
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| Molecular Weight |
490.57
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| Canonical SMILES |
CCc1cc(CN2CCC(CC2)C(=O)NC(C)(C)C)cc(NC(=O)c2cccc(n2)C(F)(F)F)c1
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| InChI |
InChI=1S/C26H33F3N4O2/c1-5-17-13-18(16-33-11-9-19(10-12-33)23(34)32-25(2,3)4)15-20(14-17)30-24(35)21-7-6-8-22(31-21)26(27,28)29/h6-8,13-15,19H,5,9-12,16H2,1-4H3,(H,30,35)(H,32,34)
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| InChIKey |
RTAHWVJMHOYKEC-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