General Information of the Compound
| Compound ID |
CP0531247
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| Compound Name |
5-[5-(1-oxo-3H-2-benzofuran-5-yl)thiophen-2-yl]pyridine-2-carboxamide
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| Structure |
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| Formula |
C18H12N2O3S
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| Molecular Weight |
336.372
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| Canonical SMILES |
NC(=O)c1ccc(cn1)-c1ccc(s1)-c1ccc2C(=O)OCc2c1
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| InChI |
InChI=1S/C18H12N2O3S/c19-17(21)14-4-2-11(8-20-14)16-6-5-15(24-16)10-1-3-13-12(7-10)9-23-18(13)22/h1-8H,9H2,(H2,19,21)
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| InChIKey |
ZHXKLRNCGNSIRI-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