General Information of the Compound
| Compound ID |
CP0497666
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| Compound Name |
7-amino-3-[(4-methoxyphenyl)methyl]triazolo[4,5-d]pyrimidine-5-carboxamide
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| Structure |
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| Formula |
C13H13N7O2
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| Molecular Weight |
299.294
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| Canonical SMILES |
COc1ccc(Cn2nnc3c(N)nc(nc23)C(N)=O)cc1
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| InChI |
InChI=1S/C13H13N7O2/c1-22-8-4-2-7(3-5-8)6-20-13-9(18-19-20)10(14)16-12(17-13)11(15)21/h2-5H,6H2,1H3,(H2,15,21)(H2,14,16,17)
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| InChIKey |
SGFOYQHLHJGSQI-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