General Information of the Compound
| Compound ID |
CP0568595
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| Compound Name |
US9012651, 26
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| Structure |
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| Formula |
C16H28N2O2
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| Molecular Weight |
280.412
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| Canonical SMILES |
CC(O)CC(C)CNCc1cccc(OC(C)(C)C)n1
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| InChI |
InChI=1S/C16H28N2O2/c1-12(9-13(2)19)10-17-11-14-7-6-8-15(18-14)20-16(3,4)5/h6-8,12-13,17,19H,9-11H2,1-5H3
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| InChIKey |
HANZWZYWTAIZOE-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