General Information of the Compound
| Compound ID |
CP0469277
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| Compound Name |
4-(5-amino-3-pyridin-2-yl-1,2,4-triazol-1-yl)-7-chloroquinazolin-6-amine
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| Structure |
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| Formula |
C15H11ClN8
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| Molecular Weight |
338.762
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| Canonical SMILES |
Nc1nc(nn1-c1ncnc2cc(Cl)c(N)cc12)-c1ccccn1
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| InChI |
InChI=1S/C15H11ClN8/c16-9-6-12-8(5-10(9)17)14(21-7-20-12)24-15(18)22-13(23-24)11-3-1-2-4-19-11/h1-7H,17H2,(H2,18,22,23)
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| InChIKey |
LQRBKZGBFYFJGS-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