General Information of the Compound
| Compound ID |
CP0962716
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| Compound Name |
1,2-Dimethyl-1,4-dihydro-2H-3-thia-2,4,5-triaza-phenanthrene 3,3-dioxide
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| Structure |
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| Formula |
C12H13N3O2S
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| Molecular Weight |
263.322
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| Canonical SMILES |
CC1c2ccc3cccnc3c2NS(=O)(=O)N1C
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| InChI |
InChI=1S/C12H13N3O2S/c1-8-10-6-5-9-4-3-7-13-11(9)12(10)14-18(16,17)15(8)2/h3-8,14H,1-2H3
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| InChIKey |
RMJIRNDEKYYQRS-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