General Information of the Compound
| Compound ID |
CP0419310
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| Compound Name |
2,6-Disubstituted Pyrazine, 9
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| Structure |
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| Formula |
C22H23N3O5
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| Molecular Weight |
409.442
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| Canonical SMILES |
CCOC(=O)c1cccc(c1)-c1cncc(Nc2cc(OC)c(OC)c(OC)c2)n1
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| InChI |
InChI=1S/C22H23N3O5/c1-5-30-22(26)15-8-6-7-14(9-15)17-12-23-13-20(25-17)24-16-10-18(27-2)21(29-4)19(11-16)28-3/h6-13H,5H2,1-4H3,(H,24,25)
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| InChIKey |
LAUOTLUUDUQZKV-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