General Information of the Compound
| Compound ID |
CP0508541
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| Compound Name |
4-(5-amino-3-pyridin-2-yl-1,2,4-triazol-1-yl)-7-methoxyquinazolin-6-amine
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| Structure |
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| Formula |
C16H14N8O
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| Molecular Weight |
334.343
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| Canonical SMILES |
COc1cc2ncnc(-n3nc(nc3N)-c3ccccn3)c2cc1N
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| InChI |
InChI=1S/C16H14N8O/c1-25-13-7-12-9(6-10(13)17)15(21-8-20-12)24-16(18)22-14(23-24)11-4-2-3-5-19-11/h2-8H,17H2,1H3,(H2,18,22,23)
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| InChIKey |
ZVYPUMKJRINKBC-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