General Information of the Compound
| Compound ID |
CP0385530
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| Compound Name |
[3-[4-(methylsulfonylmethyl)-6-morpholin-4-ylpyrimidin-2-yl]phenyl]methanol
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| Structure |
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| Formula |
C17H21N3O4S
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| Molecular Weight |
363.439
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| Canonical SMILES |
CS(=O)(=O)Cc1cc(nc(n1)-c1cccc(CO)c1)N1CCOCC1
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| InChI |
InChI=1S/C17H21N3O4S/c1-25(22,23)12-15-10-16(20-5-7-24-8-6-20)19-17(18-15)14-4-2-3-13(9-14)11-21/h2-4,9-10,21H,5-8,11-12H2,1H3
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| InChIKey |
SDAVLBYUVPQGLR-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