General Information of the Compound
| Compound ID |
CP0554555
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| Compound Name |
US9586948, Example 2
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| Structure |
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| Formula |
C15H14N6O2
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| Molecular Weight |
310.317
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| Canonical SMILES |
Cn1cc(NC(=O)c2cccc(n2)-n2cccc2)c(n1)C(N)=O
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| InChI |
InChI=1S/C15H14N6O2/c1-20-9-11(13(19-20)14(16)22)18-15(23)10-5-4-6-12(17-10)21-7-2-3-8-21/h2-9H,1H3,(H2,16,22)(H,18,23)
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| InChIKey |
RSFNLGZFWLZMBQ-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