General Information of the Compound
| Compound ID |
CP0956614
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| Compound Name |
N-(2-(4-(2,4-difluorophenoxy)piperidin-1-yl)-5-(methylsulfonyl)phenyl)-3-fluoro-2-methoxybenzamide
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| Structure |
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| Formula |
C26H25F3N2O5S
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| Molecular Weight |
534.556
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| Canonical SMILES |
COc1c(F)cccc1C(=O)Nc1cc(S(C)(=O)=O)ccc1N1CCC(Oc2ccc(F)cc2F)CC1
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| InChI |
InChI=1S/C26H25F3N2O5S/c1-35-25-19(4-3-5-20(25)28)26(32)30-22-15-18(37(2,33)34)7-8-23(22)31-12-10-17(11-13-31)36-24-9-6-16(27)14-21(24)29/h3-9,14-15,17H,10-13H2,1-2H3,(H,30,32)
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| InChIKey |
OPOOLIHXTIRCLG-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