General Information of the Compound
| Compound ID |
CP0443551
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| Compound Name |
N-[3-(benzenesulfonyl)-2-methylsulfanylpyrido[1,2-a]pyrimidin-4-ylidene]acetamide
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| Formula |
C17H15N3O3S2
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| Molecular Weight |
373.459
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| Canonical SMILES |
CSc1nc2ccccn2\c(=N/C(C)=O)c1S(=O)(=O)c1ccccc1
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| InChI |
InChI=1S/C17H15N3O3S2/c1-12(21)18-16-15(25(22,23)13-8-4-3-5-9-13)17(24-2)19-14-10-6-7-11-20(14)16/h3-11H,1-2H3/b18-16-
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| InChIKey |
FJBVNHBVNXHVJN-VLGSPTGOSA-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