General Information of the Compound
| Compound ID |
CP0550647
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| Compound Name |
US9278960, 6-19
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| Structure |
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| Formula |
C20H18N6O2
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| Molecular Weight |
374.404
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| Canonical SMILES |
COc1ncc(Cc2ccc3c(cc(nc3c2)C(N)=O)-c2cnn(C)c2)cn1
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| InChI |
InChI=1S/C20H18N6O2/c1-26-11-14(10-24-26)16-7-18(19(21)27)25-17-6-12(3-4-15(16)17)5-13-8-22-20(28-2)23-9-13/h3-4,6-11H,5H2,1-2H3,(H2,21,27)
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| InChIKey |
WHUKUNVNTIAHGT-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