General Information of the Compound
| Compound ID |
CP0870812
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| Compound Name |
4-(4-Trifluoromethylphenyl)piperidinium chloride
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| Structure |
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| Formula |
C12H15ClF3N
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| Molecular Weight |
265.706
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| Canonical SMILES |
Cl.FC(F)(F)c1ccc(C2CCNCC2)cc1
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| InChI |
InChI=1S/C12H14F3N.ClH/c13-12(14,15)11-3-1-9(2-4-11)10-5-7-16-8-6-10;/h1-4,10,16H,5-8H2;1H
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| InChIKey |
KURKYPUJETYTIT-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