General Information of the Compound
| Compound ID |
CP0579634
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| Compound Name |
N-(2-methyl-6-morpholin-4-ylpyridin-3-yl)-N-(2-methylpropyl)-2-(oxan-4-yl)-4-oxo-2,3-dihydrochromene-6-sulfonamide
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| Structure |
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| Formula |
C28H37N3O6S
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| Molecular Weight |
543.686
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| Canonical SMILES |
CC(C)CN(c1ccc(nc1C)N1CCOCC1)S(=O)(=O)c1ccc2OC(CC(=O)c2c1)C1CCOCC1
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| InChI |
InChI=1S/C28H37N3O6S/c1-19(2)18-31(24-5-7-28(29-20(24)3)30-10-14-36-15-11-30)38(33,34)22-4-6-26-23(16-22)25(32)17-27(37-26)21-8-12-35-13-9-21/h4-7,16,19,21,27H,8-15,17-18H2,1-3H3
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| InChIKey |
CAEUPBZZZIXUHO-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