General Information of the Compound
| Compound ID |
CP0494119
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| Compound Name |
2-[4-(1-amino-2,4-dicyanopyrido[1,2-a]benzimidazol-3-yl)phenoxy]-N-(2-hydroxyethyl)acetamide
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| Structure |
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| Formula |
C23H18N6O3
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| Molecular Weight |
426.436
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| Canonical SMILES |
Nc1c(C#N)c(-c2ccc(OCC(=O)NCCO)cc2)c(C#N)c2nc3ccccc3n12
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| InChI |
InChI=1S/C23H18N6O3/c24-11-16-21(14-5-7-15(8-6-14)32-13-20(31)27-9-10-30)17(12-25)23-28-18-3-1-2-4-19(18)29(23)22(16)26/h1-8,30H,9-10,13,26H2,(H,27,31)
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| InChIKey |
USXCWYOQEVOBOA-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