General Information of the Compound
| Compound ID |
CP0119276
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| Compound Name |
N-[4-(2-fluoropyridin-4-yl)thiophen-2-yl]-2-(3-methoxyphenyl)acetamide
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| Structure |
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| Formula |
C18H15FN2O2S
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| Molecular Weight |
342.395
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| Canonical SMILES |
COc1cccc(CC(=O)Nc2cc(cs2)-c2ccnc(F)c2)c1
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| InChI |
InChI=1S/C18H15FN2O2S/c1-23-15-4-2-3-12(7-15)8-17(22)21-18-10-14(11-24-18)13-5-6-20-16(19)9-13/h2-7,9-11H,8H2,1H3,(H,21,22)
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| InChIKey |
ZTXPZKBYVPEULR-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