General Information of the Compound
| Compound ID |
CP0419156
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| Compound Name |
US9278960, 3-27
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| Structure |
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| Formula |
C22H17FN4O3
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| Molecular Weight |
404.401
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| Canonical SMILES |
COC(=O)c1cn(Cc2ccc3c(cc(nc3c2)C(N)=O)-c2ccc(F)cc2)cn1
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| InChI |
InChI=1S/C22H17FN4O3/c1-30-22(29)20-11-27(12-25-20)10-13-2-7-16-17(14-3-5-15(23)6-4-14)9-19(21(24)28)26-18(16)8-13/h2-9,11-12H,10H2,1H3,(H2,24,28)
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| InChIKey |
MKHVYABIDNNOLA-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