General Information of the Compound
| Compound ID |
CP0063401
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| Compound Name |
CHEMBL269850
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| Formula |
C15H13N3O3S
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| Molecular Weight |
315.354
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| Canonical SMILES |
NS(=O)(=O)c1ccc(N\C=C2/C(=O)Nc3ccccc23)cc1
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| InChI |
InChI=1S/C15H13N3O3S/c16-22(20,21)11-7-5-10(6-8-11)17-9-13-12-3-1-2-4-14(12)18-15(13)19/h1-9,17H,(H,18,19)(H2,16,20,21)/b13-9-
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| InChIKey |
PWGAHYYSCYXLLY-LCYFTJDESA-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