General Information of the Compound
| Compound ID |
CP0444492
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| Compound Name |
2-(2-naphthalen-2-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(CCc2ccc3ccccc3c2)sc2ccccc12
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| InChI |
InChI=1S/C19H15NOS/c21-19-17-7-3-4-8-18(17)22-20(19)12-11-14-9-10-15-5-1-2-6-16(15)13-14/h1-10,13H,11-12H2
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| InChIKey |
JAMJYXGKSDKFBH-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