General Information of the Compound
| Compound ID |
CP0047456
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| Compound Name |
2-[(E)-2-(3-methyl-2-thienyl)vinyl]quinoline
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| Structure |
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| Formula |
C16H13NS
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| Molecular Weight |
251.354
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| Canonical SMILES |
Cc1ccsc1\C=C\c1ccc2ccccc2n1
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| InChI |
InChI=1S/C16H13NS/c1-12-10-11-18-16(12)9-8-14-7-6-13-4-2-3-5-15(13)17-14/h2-11H,1H3/b9-8+
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| InChIKey |
TZZRBHONFLVZSC-CMDGGOBGSA-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