General Information of the Compound
| Compound ID |
CP0539498
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| Compound Name |
US9428456, 1.337
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| Structure |
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| Formula |
C26H33N3O2
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| Molecular Weight |
419.569
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| Canonical SMILES |
CC(C)(C)NC(=O)C1CCN(Cc2cccc(NC(=O)\C=C\c3ccccc3)c2)CC1
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| InChI |
InChI=1S/C26H33N3O2/c1-26(2,3)28-25(31)22-14-16-29(17-15-22)19-21-10-7-11-23(18-21)27-24(30)13-12-20-8-5-4-6-9-20/h4-13,18,22H,14-17,19H2,1-3H3,(H,27,30)(H,28,31)/b13-12+
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| InChIKey |
UFRMZMRSWUIURW-OUKQBFOZSA-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