General Information of the Compound
| Compound ID |
CP0380035
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| Compound Name |
N-methyl-2-[4-[[3-(trifluoromethyl)phenyl]methoxy]piperidin-1-yl]ethanamine
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| Structure |
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| Formula |
C16H23F3N2O
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| Molecular Weight |
316.367
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| Canonical SMILES |
CNCCN1CCC(CC1)OCc1cccc(c1)C(F)(F)F
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| InChI |
InChI=1S/C16H23F3N2O/c1-20-7-10-21-8-5-15(6-9-21)22-12-13-3-2-4-14(11-13)16(17,18)19/h2-4,11,15,20H,5-10,12H2,1H3
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| InChIKey |
AAFISRHSQOGOSG-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