General Information of the Compound
| Compound ID |
CP0014159
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| Compound Name |
N-[2-methoxy-5-[7-(3-morpholin-4-yl-2-oxopropyl)-1,3-dihydro-2-benzofuran-5-yl]pyridin-3-yl]methanesulfonamide
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| Structure |
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| Formula |
C22H27N3O6S
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| Molecular Weight |
461.54
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| Canonical SMILES |
COc1ncc(cc1NS(C)(=O)=O)-c1cc2COCc2c(CC(=O)CN2CCOCC2)c1
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| InChI |
InChI=1S/C22H27N3O6S/c1-29-22-21(24-32(2,27)28)10-17(11-23-22)15-7-16(20-14-31-13-18(20)8-15)9-19(26)12-25-3-5-30-6-4-25/h7-8,10-11,24H,3-6,9,12-14H2,1-2H3
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| InChIKey |
SQFZMTRTGQOCRA-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