General Information of the Compound
| Compound ID |
CP0409308
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| Compound Name |
US9409917, 31
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| Structure |
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| Formula |
C17H17ClN2O2
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| Molecular Weight |
316.788
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| Canonical SMILES |
Cc1c(Cl)cccc1CNC(=O)C1CCOc2ncccc12
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| InChI |
InChI=1S/C17H17ClN2O2/c1-11-12(4-2-6-15(11)18)10-20-16(21)13-7-9-22-17-14(13)5-3-8-19-17/h2-6,8,13H,7,9-10H2,1H3,(H,20,21)
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| InChIKey |
VMKAYXRJJXYVST-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