General Information of the Compound
| Compound ID |
CP0185655
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| Compound Name |
2-(4-Chloro-phenyl)-6-morpholin-4-yl-thiopyran-4-one
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| Structure |
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| Formula |
C15H14ClNO2S
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| Molecular Weight |
307.802
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| Canonical SMILES |
Clc1ccc(cc1)-c1cc(=O)cc(s1)N1CCOCC1
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| InChI |
InChI=1S/C15H14ClNO2S/c16-12-3-1-11(2-4-12)14-9-13(18)10-15(20-14)17-5-7-19-8-6-17/h1-4,9-10H,5-8H2
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| InChIKey |
WVAMXZOUPLIOOT-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