General Information of the Compound
| Compound ID |
CP0248837
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| Compound Name |
4-tert-butyl-N-(6,7-dihydro-5H-[1,2,4]triazolo[3,4-b][1,3]thiazin-3-yl)benzamide
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| Structure |
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| Formula |
C16H20N4OS
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| Molecular Weight |
316.43
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| Canonical SMILES |
CC(C)(C)c1ccc(cc1)C(=O)Nc1nnc2SCCCn12
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| InChI |
InChI=1S/C16H20N4OS/c1-16(2,3)12-7-5-11(6-8-12)13(21)17-14-18-19-15-20(14)9-4-10-22-15/h5-8H,4,9-10H2,1-3H3,(H,17,18,21)
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| InChIKey |
DXKTUEURAASGGW-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