General Information of the Compound
| Compound ID |
CP0469273
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| Compound Name |
2-(6,7-dimethoxy-2-morpholin-4-ylquinazolin-4-yl)-5-pyridin-2-yl-1,2,4-triazol-3-amine
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| Structure |
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| Formula |
C21H22N8O3
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| Molecular Weight |
434.46
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| Canonical SMILES |
COc1cc2nc(nc(-n3nc(nc3N)-c3ccccn3)c2cc1OC)N1CCOCC1
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| InChI |
InChI=1S/C21H22N8O3/c1-30-16-11-13-15(12-17(16)31-2)24-21(28-7-9-32-10-8-28)26-19(13)29-20(22)25-18(27-29)14-5-3-4-6-23-14/h3-6,11-12H,7-10H2,1-2H3,(H2,22,25,27)
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| InChIKey |
FFTLEYLETXOQQM-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