General Information of the Compound
| Compound ID |
CP0518431
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| Compound Name |
2-(2-naphthalen-1-ylethyl)-1,2-benzothiazol-3-one
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| Structure |
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| Formula |
C19H15NOS
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| Molecular Weight |
305.402
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| Canonical SMILES |
O=c1n(CCc2cccc3ccccc23)sc2ccccc12
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| InChI |
InChI=1S/C19H15NOS/c21-19-17-10-3-4-11-18(17)22-20(19)13-12-15-8-5-7-14-6-1-2-9-16(14)15/h1-11H,12-13H2
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| InChIKey |
CRSKILIJJONTLJ-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