General Information of the Compound
| Compound ID |
CP0012686
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| Compound Name |
1-[2-[[3-(4-fluorophenyl)-5-methyl-1,2-oxazol-4-yl]methoxy]-7,8-dihydro-5H-1,6-naphthyridin-6-yl]ethanone
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| Formula |
C21H20FN3O3
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| Molecular Weight |
381.407
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| Canonical SMILES |
CC(=O)N1CCc2nc(OCc3c(C)onc3-c3ccc(F)cc3)ccc2C1
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| InChI |
InChI=1S/C21H20FN3O3/c1-13-18(21(24-28-13)15-3-6-17(22)7-4-15)12-27-20-8-5-16-11-25(14(2)26)10-9-19(16)23-20/h3-8H,9-12H2,1-2H3
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| InChIKey |
FVRQRXRVKLGUHG-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