General Information of the Compound
| Compound ID |
CP0532681
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| Compound Name |
US8927539, 5
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| Structure |
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| Formula |
C26H32N4O2
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| Molecular Weight |
432.568
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| Canonical SMILES |
CC(C)(C)CC1(CCN(C(=O)O1)C(C)(C)c1cn(nn1)-c1ccccc1)c1ccccc1
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| InChI |
InChI=1S/C26H32N4O2/c1-24(2,3)19-26(20-12-8-6-9-13-20)16-17-29(23(31)32-26)25(4,5)22-18-30(28-27-22)21-14-10-7-11-15-21/h6-15,18H,16-17,19H2,1-5H3
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| InChIKey |
YKECSXDVYXEQDN-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