General Information of the Compound
| Compound ID |
CP0576499
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| Compound Name |
US9428456, 1.333
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| Structure |
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| Formula |
C26H36N4O2
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| Molecular Weight |
436.6
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| Canonical SMILES |
CCc1ccc(NC(=O)c2cncc(C)c2)cc1CN1CCC(CC1)C(=O)NC(C)(C)C
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| InChI |
InChI=1S/C26H36N4O2/c1-6-19-7-8-23(28-24(31)21-13-18(2)15-27-16-21)14-22(19)17-30-11-9-20(10-12-30)25(32)29-26(3,4)5/h7-8,13-16,20H,6,9-12,17H2,1-5H3,(H,28,31)(H,29,32)
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| InChIKey |
MTKCTKBRNMIHHL-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