General Information of the Compound
| Compound ID |
CP0508285
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| Compound Name |
2-[4-(1-amino-2,4-dicyano-6-methoxypyrido[1,2-a]benzimidazol-3-yl)phenoxy]acetamide
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| Structure |
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| Formula |
C22H16N6O3
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| Molecular Weight |
412.409
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| Canonical SMILES |
COc1cccc2c1nc1c(C#N)c(-c3ccc(OCC(N)=O)cc3)c(C#N)c(N)n21
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| InChI |
InChI=1S/C22H16N6O3/c1-30-17-4-2-3-16-20(17)27-22-15(10-24)19(14(9-23)21(26)28(16)22)12-5-7-13(8-6-12)31-11-18(25)29/h2-8H,11,26H2,1H3,(H2,25,29)
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| InChIKey |
AMEFBVBZKUTXFK-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