General Information of the Compound
| Compound ID |
CP0456151
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| Compound Name |
US9169260, 130
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| Structure |
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| Formula |
C20H18N6O
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| Molecular Weight |
358.405
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| Canonical SMILES |
Cc1ccc(cc1)-n1nc(cc1NC(=O)c1cnn2cccnc12)C1CC1
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| InChI |
InChI=1S/C20H18N6O/c1-13-3-7-15(8-4-13)26-18(11-17(24-26)14-5-6-14)23-20(27)16-12-22-25-10-2-9-21-19(16)25/h2-4,7-12,14H,5-6H2,1H3,(H,23,27)
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| InChIKey |
PPOCZDIVNJUVHJ-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