General Information of the Compound
| Compound ID |
CP0161401
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| Compound Name |
2-(3,4-Methylenedioxyphenylamino)-6-(3-acetamidophenyl)-pyrazine
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| Structure |
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| Formula |
C19H16N4O3
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| Molecular Weight |
348.362
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| Canonical SMILES |
CC(=O)Nc1cccc(c1)-c1cncc(Nc2ccc3OCOc3c2)n1
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| InChI |
InChI=1S/C19H16N4O3/c1-12(24)21-14-4-2-3-13(7-14)16-9-20-10-19(23-16)22-15-5-6-17-18(8-15)26-11-25-17/h2-10H,11H2,1H3,(H,21,24)(H,22,23)
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| InChIKey |
VCQYSCPNENRBFZ-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