General Information of the Compound
| Compound ID |
CP0199313
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| Compound Name |
N-[6-[2-(3-fluorophenyl)sulfanylpyrimidin-4-yl]-1,3-benzothiazol-2-yl]acetamide
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| Structure |
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| Formula |
C19H13FN4OS2
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| Molecular Weight |
396.472
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| Canonical SMILES |
CC(=O)Nc1nc2ccc(cc2s1)-c1ccnc(Sc2cccc(F)c2)n1
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| InChI |
InChI=1S/C19H13FN4OS2/c1-11(25)22-19-24-16-6-5-12(9-17(16)27-19)15-7-8-21-18(23-15)26-14-4-2-3-13(20)10-14/h2-10H,1H3,(H,22,24,25)
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| InChIKey |
NUONSZZBOOKGRC-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