General Information of the Compound
| Compound ID |
CP0504329
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| Compound Name |
2-(3-methylsulfonylphenyl)-N-(piperidin-4-ylmethyl)benzamide
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| Structure |
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| Formula |
C20H24N2O3S
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| Molecular Weight |
372.49
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| Canonical SMILES |
CS(=O)(=O)c1cccc(c1)-c1ccccc1C(=O)NCC1CCNCC1
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| InChI |
InChI=1S/C20H24N2O3S/c1-26(24,25)17-6-4-5-16(13-17)18-7-2-3-8-19(18)20(23)22-14-15-9-11-21-12-10-15/h2-8,13,15,21H,9-12,14H2,1H3,(H,22,23)
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| InChIKey |
YDLHHEGFZAJTOU-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