General Information of the Compound
| Compound ID |
CP0300648
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| Compound Name |
5-(benzenesulfonyl)-N-[1-(3-chlorobenzoyl)piperidin-4-yl]-2-(trifluoromethyl)benzenesulfonamide
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| Structure |
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| Formula |
C25H22ClF3N2O5S2
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| Molecular Weight |
587.041
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| Canonical SMILES |
FC(F)(F)c1ccc(cc1S(=O)(=O)NC1CCN(CC1)C(=O)c1cccc(Cl)c1)S(=O)(=O)c1ccccc1
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| InChI |
InChI=1S/C25H22ClF3N2O5S2/c26-18-6-4-5-17(15-18)24(32)31-13-11-19(12-14-31)30-38(35,36)23-16-21(9-10-22(23)25(27,28)29)37(33,34)20-7-2-1-3-8-20/h1-10,15-16,19,30H,11-14H2
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| InChIKey |
NXZLEGQRQRCEMR-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