General Information of the Compound
| Compound ID |
CP0448768
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| Compound Name |
3-[5-(4-methoxyphenyl)-1-methylpyrazol-4-yl]-5-propoxy-[1,2,4]triazolo[4,3-a]pyrazine
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| Structure |
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| Formula |
C19H20N6O2
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| Molecular Weight |
364.409
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| Canonical SMILES |
CCCOc1cncc2nnc(-c3cnn(C)c3-c3ccc(OC)cc3)n12
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| InChI |
InChI=1S/C19H20N6O2/c1-4-9-27-17-12-20-11-16-22-23-19(25(16)17)15-10-21-24(2)18(15)13-5-7-14(26-3)8-6-13/h5-8,10-12H,4,9H2,1-3H3
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| InChIKey |
AROOUARGNSNYHD-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