General Information of the Compound
| Compound ID |
CP0408178
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| Compound Name |
N-[3-(4-cyanonaphthalen-1-yl)pyridin-4-yl]-2-methylpropane-1-sulfonamide
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| Structure |
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| Formula |
C20H19N3O2S
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| Molecular Weight |
365.458
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| Canonical SMILES |
CC(C)CS(=O)(=O)Nc1ccncc1-c1ccc(C#N)c2ccccc12
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| InChI |
InChI=1S/C20H19N3O2S/c1-14(2)13-26(24,25)23-20-9-10-22-12-19(20)18-8-7-15(11-21)16-5-3-4-6-17(16)18/h3-10,12,14H,13H2,1-2H3,(H,22,23)
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| InChIKey |
HJRBQRNYRJUBRA-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