General Information of the Compound
| Compound ID |
CP0157377
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| Compound Name |
5-(Phenylsulfonyl)-N-[1-(pyridin-3-ylcarbonyl)piperidin-4-yl]-2-(trifluoromethyl)benzenesulfonamide
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| Structure |
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| Formula |
C24H22F3N3O5S2
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| Molecular Weight |
553.584
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| Canonical SMILES |
FC(F)(F)c1ccc(cc1S(=O)(=O)NC1CCN(CC1)C(=O)c1ccccn1)S(=O)(=O)c1ccccc1
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| InChI |
InChI=1S/C24H22F3N3O5S2/c25-24(26,27)20-10-9-19(36(32,33)18-6-2-1-3-7-18)16-22(20)37(34,35)29-17-11-14-30(15-12-17)23(31)21-8-4-5-13-28-21/h1-10,13,16-17,29H,11-12,14-15H2
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| InChIKey |
KTXPWQMRCCXMLX-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