General Information of the Compound
| Compound ID |
CP0487049
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| Compound Name |
3-(4-chloro-2,5-dimethylphenyl)sulfonyl-2-methylsulfanylpyrido[1,2-a]pyrimidin-4-imine
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| Structure |
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| Formula |
C17H16ClN3O2S2
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| Molecular Weight |
393.921
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| Canonical SMILES |
CSc1nc2ccccn2c(=N)c1S(=O)(=O)c1cc(C)c(Cl)cc1C
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| InChI |
InChI=1S/C17H16ClN3O2S2/c1-10-9-13(11(2)8-12(10)18)25(22,23)15-16(19)21-7-5-4-6-14(21)20-17(15)24-3/h4-9,19H,1-3H3
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| InChIKey |
MUEZMSLOVAZPOA-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