General Information of the Compound
| Compound ID |
CP0414553
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| Compound Name |
US9278960, 2-19
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| Structure |
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| Formula |
C21H15FN4O2
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| Molecular Weight |
374.375
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| Canonical SMILES |
CN1CC(=O)N(Cc2ccc3c(cc(nc3c2)C#N)-c2ccc(F)cc2)C1=O
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| InChI |
InChI=1S/C21H15FN4O2/c1-25-12-20(27)26(21(25)28)11-13-2-7-17-18(14-3-5-15(22)6-4-14)9-16(10-23)24-19(17)8-13/h2-9H,11-12H2,1H3
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| InChIKey |
GBDJXOQJHMYYCQ-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