General Information of the Compound
| Compound ID |
CP0434471
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| Compound Name |
3-(benzenesulfonyl)-2-methylsulfanyl-8-propylpyrido[1,2-a]pyrimidin-4-imine
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| Structure |
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| Formula |
C18H19N3O2S2
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| Molecular Weight |
373.503
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| Canonical SMILES |
CCCc1ccn2c(c1)nc(SC)c(c2=N)S(=O)(=O)c1ccccc1
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| InChI |
InChI=1S/C18H19N3O2S2/c1-3-7-13-10-11-21-15(12-13)20-18(24-2)16(17(21)19)25(22,23)14-8-5-4-6-9-14/h4-6,8-12,19H,3,7H2,1-2H3
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| InChIKey |
RHPMAODCOKETGN-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