General Information of the Compound
| Compound ID |
CP0424468
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| Compound Name |
6-ethyl-3-methoxy-5-[2-methoxy-4-(trifluoromethyl)phenyl]-N-pentan-3-ylpyrazin-2-amine
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| Structure |
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| Formula |
C20H26F3N3O2
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| Molecular Weight |
397.441
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| Canonical SMILES |
CCC(CC)Nc1nc(CC)c(nc1OC)-c1ccc(cc1OC)C(F)(F)F
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| InChI |
InChI=1S/C20H26F3N3O2/c1-6-13(7-2)24-18-19(28-5)26-17(15(8-3)25-18)14-10-9-12(20(21,22)23)11-16(14)27-4/h9-11,13H,6-8H2,1-5H3,(H,24,25)
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| InChIKey |
GZJIZFUBOCBTJD-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