General Information of the Compound
| Compound ID |
CP0465974
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| Compound Name |
1,1,1-trifluoro-2-(4-((S)-2-methylpiperidin-1-ylsulfonyl)phenyl)propan-2-ol
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| Structure |
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| Formula |
C15H20F3NO3S
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| Molecular Weight |
351.39
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| Canonical SMILES |
C[C@H]1CCCCN1S(=O)(=O)c1ccc(cc1)C(C)(O)C(F)(F)F
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| InChI |
InChI=1S/C15H20F3NO3S/c1-11-5-3-4-10-19(11)23(21,22)13-8-6-12(7-9-13)14(2,20)15(16,17)18/h6-9,11,20H,3-5,10H2,1-2H3/t11-,14?/m0/s1
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| InChIKey |
QRCDVMTVNXZJMW-ZSOXZCCMSA-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