General Information of the Compound
| Compound ID |
CP0514350
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| Compound Name |
N-[1-[(2-ethyl-1,3-benzoxazol-6-yl)methyl]piperidin-4-yl]-7-fluoro-4-oxochromene-2-carboxamide
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| Structure |
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| Formula |
C25H24FN3O4
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| Molecular Weight |
449.482
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| Canonical SMILES |
CCc1nc2ccc(CN3CCC(CC3)NC(=O)c3cc(=O)c4ccc(F)cc4o3)cc2o1
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| InChI |
InChI=1S/C25H24FN3O4/c1-2-24-28-19-6-3-15(11-22(19)33-24)14-29-9-7-17(8-10-29)27-25(31)23-13-20(30)18-5-4-16(26)12-21(18)32-23/h3-6,11-13,17H,2,7-10,14H2,1H3,(H,27,31)
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| InChIKey |
PJPINZQDGHCYRP-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