General Information of the Compound
| Compound ID |
CP0345059
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| Compound Name |
5-(benzenesulfonyl)-N-[1-[2-(dimethylamino)acetyl]piperidin-4-yl]-2-(trifluoromethyl)benzenesulfonamide
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| Structure |
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| Formula |
C22H26F3N3O5S2
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| Molecular Weight |
533.594
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| Canonical SMILES |
CN(C)CC(=O)N1CCC(CC1)NS(=O)(=O)c1cc(ccc1C(F)(F)F)S(=O)(=O)c1ccccc1
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| InChI |
InChI=1S/C22H26F3N3O5S2/c1-27(2)15-21(29)28-12-10-16(11-13-28)26-35(32,33)20-14-18(8-9-19(20)22(23,24)25)34(30,31)17-6-4-3-5-7-17/h3-9,14,16,26H,10-13,15H2,1-2H3
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| InChIKey |
NVMIMPZDKGYUQC-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