General Information of the Compound
| Compound ID |
CP0516382
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| Compound Name |
US9278960, 7-30
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| Structure |
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| Formula |
C21H18FN5O2
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| Molecular Weight |
391.406
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| Canonical SMILES |
COc1ncccc1Cc1ccc2c(cc(nc2c1F)C(N)=O)-c1cnn(C)c1
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| InChI |
InChI=1S/C21H18FN5O2/c1-27-11-14(10-25-27)16-9-17(20(23)28)26-19-15(16)6-5-12(18(19)22)8-13-4-3-7-24-21(13)29-2/h3-7,9-11H,8H2,1-2H3,(H2,23,28)
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| InChIKey |
WRQVCJKYDGXPHS-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