General Information of the Compound
| Compound ID |
CP0528355
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| Compound Name |
2-[(4-methoxyphenyl)-thiophen-2-ylmethyl]pyridine
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| Formula |
C17H15NOS
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| Molecular Weight |
281.38
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| Canonical SMILES |
COc1ccc(cc1)C(c1cccs1)c1ccccn1
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| InChI |
InChI=1S/C17H15NOS/c1-19-14-9-7-13(8-10-14)17(16-6-4-12-20-16)15-5-2-3-11-18-15/h2-12,17H,1H3
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| InChIKey |
XYWLACIFIFTVPK-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