General Information of the Compound
| Compound ID |
CP0490678
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| Compound Name |
4-(4-Oxo-8-phenyl-4H-chromen-2-yl)-1lambda*4*-thiomorpholin-1-ol anion
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| Structure |
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| Formula |
C19H17NO3S
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| Molecular Weight |
339.416
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| Canonical SMILES |
O=S1CCN(CC1)c1cc(=O)c2cccc(-c3ccccc3)c2o1
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| InChI |
InChI=1S/C19H17NO3S/c21-17-13-18(20-9-11-24(22)12-10-20)23-19-15(7-4-8-16(17)19)14-5-2-1-3-6-14/h1-8,13H,9-12H2
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| InChIKey |
BACNUWXYWGNYNE-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