General Information of the Compound
| Compound ID |
CP0014913
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| Compound Name |
4-[(1,3-dimethylpyrazolo[4,3-e][1,2,4]triazin-5-yl)amino]-N-(1-hydroxy-3-methylbutan-2-yl)benzenesulfonamide
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| Structure |
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| Formula |
C17H23N7O3S
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| Molecular Weight |
405.484
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| Canonical SMILES |
CC(C)C(CO)NS(=O)(=O)c1ccc(Nc2nnc3n(C)nc(C)c3n2)cc1
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| InChI |
InChI=1S/C17H23N7O3S/c1-10(2)14(9-25)23-28(26,27)13-7-5-12(6-8-13)18-17-19-15-11(3)22-24(4)16(15)20-21-17/h5-8,10,14,23,25H,9H2,1-4H3,(H,18,19,21)
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| InChIKey |
PNAJPNITYVIHPP-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