General Information of the Compound
| Compound ID |
CP0415461
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| Compound Name |
4-chloro-N-[3-(6-methyl-1,3-dioxo-2-propan-2-ylpyrrolo[3,4-c]pyridin-4-yl)oxyphenyl]benzamide
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| Structure |
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| Formula |
C24H20ClN3O4
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| Molecular Weight |
449.894
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| Canonical SMILES |
CC(C)N1C(=O)c2cc(C)nc(Oc3cccc(NC(=O)c4ccc(Cl)cc4)c3)c2C1=O
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| InChI |
InChI=1S/C24H20ClN3O4/c1-13(2)28-23(30)19-11-14(3)26-22(20(19)24(28)31)32-18-6-4-5-17(12-18)27-21(29)15-7-9-16(25)10-8-15/h4-13H,1-3H3,(H,27,29)
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| InChIKey |
XBJNRQKBQJOQAC-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