General Information of the Compound
| Compound ID |
CP0390902
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| Compound Name |
2,5-difluoro-4-[3-(3-methoxyphenyl)morpholin-2-yl]oxy-N-(1,2,4-thiadiazol-5-yl)benzenesulfonamide
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| Structure |
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| Formula |
C19H18F2N4O5S2
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| Molecular Weight |
484.506
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| Canonical SMILES |
COc1cccc(c1)C1NCCOC1Oc1cc(F)c(cc1F)S(=O)(=O)Nc1ncns1
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| InChI |
InChI=1S/C19H18F2N4O5S2/c1-28-12-4-2-3-11(7-12)17-18(29-6-5-22-17)30-15-8-14(21)16(9-13(15)20)32(26,27)25-19-23-10-24-31-19/h2-4,7-10,17-18,22H,5-6H2,1H3,(H,23,24,25)
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| InChIKey |
CYLMLRCAQHLIPV-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