General Information of the Compound
| Compound ID |
CP0084563
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| Compound Name |
1-cyclopropyl-N-hydroxy-4-[4-[4-(trifluoromethyl)phenoxy]phenyl]sulfonylpiperidine-4-carboxamide
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| Structure |
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| Formula |
C22H23F3N2O5S
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| Molecular Weight |
484.496
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| Canonical SMILES |
ONC(=O)C1(CCN(CC1)C1CC1)S(=O)(=O)c1ccc(Oc2ccc(cc2)C(F)(F)F)cc1
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| InChI |
InChI=1S/C22H23F3N2O5S/c23-22(24,25)15-1-5-17(6-2-15)32-18-7-9-19(10-8-18)33(30,31)21(20(28)26-29)11-13-27(14-12-21)16-3-4-16/h1-2,5-10,16,29H,3-4,11-14H2,(H,26,28)
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| InChIKey |
AOPZFYOXZYZEAC-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