General Information of the Compound
| Compound ID |
CP0522104
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| Compound Name |
N-[4-(5-cyano-1-methylpyrrol-2-yl)-3,5-difluorophenyl]ethanesulfonamide
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| Structure |
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| Formula |
C14H13F2N3O2S
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| Molecular Weight |
325.34
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| Canonical SMILES |
CCS(=O)(=O)Nc1cc(F)c(-c2ccc(C#N)n2C)c(F)c1
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| InChI |
InChI=1S/C14H13F2N3O2S/c1-3-22(20,21)18-9-6-11(15)14(12(16)7-9)13-5-4-10(8-17)19(13)2/h4-7,18H,3H2,1-2H3
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| InChIKey |
YSIQBSLZQKNAIY-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