General Information of the Compound
| Compound ID |
CP0511492
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| Compound Name |
4-[5-cyano-2-(4-fluorophenyl)-6-methoxy-1H-indol-3-yl]-N-(dimethylsulfamoyl)butanamide
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| Structure |
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| Formula |
C22H23FN4O4S
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| Molecular Weight |
458.515
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| Canonical SMILES |
COc1cc2[nH]c(c(CCCC(=O)NS(=O)(=O)N(C)C)c2cc1C#N)-c1ccc(F)cc1
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| InChI |
InChI=1S/C22H23FN4O4S/c1-27(2)32(29,30)26-21(28)6-4-5-17-18-11-15(13-24)20(31-3)12-19(18)25-22(17)14-7-9-16(23)10-8-14/h7-12,25H,4-6H2,1-3H3,(H,26,28)
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| InChIKey |
HZYSYLZPHSUAIN-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