General Information of the Compound
| Compound ID |
CP0154123
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| Compound Name |
3-Benzenesulfonyl-8-ethyl-2-methylsulfanyl-pyrido[1,2-a]pyrimidin-(4Z)-ylideneamine
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| Structure |
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| Formula |
C17H17N3O2S2
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| Molecular Weight |
359.476
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| Canonical SMILES |
CCc1ccn2c(c1)nc(SC)c(c2=N)S(=O)(=O)c1ccccc1
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| InChI |
InChI=1S/C17H17N3O2S2/c1-3-12-9-10-20-14(11-12)19-17(23-2)15(16(20)18)24(21,22)13-7-5-4-6-8-13/h4-11,18H,3H2,1-2H3
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| InChIKey |
BOCANXVJTHCSDS-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