General Information of the Compound
| Compound ID |
CP0544916
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| Compound Name |
US9409917, 9
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| Structure |
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| Formula |
C17H16Cl2N2O3
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| Molecular Weight |
367.232
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| Canonical SMILES |
OC[C@@H](NC(=O)[C@H]1CCOc2ncccc12)c1ccc(Cl)cc1Cl
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| InChI |
InChI=1S/C17H16Cl2N2O3/c18-10-3-4-13(14(19)8-10)15(9-22)21-16(23)11-5-7-24-17-12(11)2-1-6-20-17/h1-4,6,8,11,15,22H,5,7,9H2,(H,21,23)/t11-,15+/m0/s1
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| InChIKey |
GACLCUGVJCORSZ-XHDPSFHLSA-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