General Information of the Compound
| Compound ID |
CP0027468
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| Compound Name |
8-[6-(dimethylcarbamoyl)pyridin-3-yl]oxy-4,5-dihydrothieno[3,4-g][1,2]benzothiazole-6-carboxamide
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| Structure |
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| Formula |
C18H16N4O3S2
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| Molecular Weight |
400.485
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| Canonical SMILES |
CN(C)C(=O)c1ccc(Oc2sc(C(N)=O)c3CCc4cnsc4-c23)cn1
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| InChI |
InChI=1S/C18H16N4O3S2/c1-22(2)17(24)12-6-4-10(8-20-12)25-18-13-11(15(26-18)16(19)23)5-3-9-7-21-27-14(9)13/h4,6-8H,3,5H2,1-2H3,(H2,19,23)
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| InChIKey |
OEHBLKFWGKSFLY-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