General Information of the Compound
| Compound ID |
CP0504885
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| Compound Name |
5-(2-chloro-4-ethoxyphenyl)-3-methoxy-6-methyl-N-pentan-3-ylpyrazin-2-amine
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| Structure |
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| Formula |
C19H26ClN3O2
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| Molecular Weight |
363.889
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| Canonical SMILES |
CCOc1ccc(c(Cl)c1)-c1nc(OC)c(NC(CC)CC)nc1C
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| InChI |
InChI=1S/C19H26ClN3O2/c1-6-13(7-2)22-18-19(24-5)23-17(12(4)21-18)15-10-9-14(25-8-3)11-16(15)20/h9-11,13H,6-8H2,1-5H3,(H,21,22)
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| InChIKey |
VDRMLMFCKUCYPK-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