General Information of the Compound
| Compound ID |
CP0457748
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| Compound Name |
N-[3-(dimethylamino)-1-naphthalen-2-ylpropyl]-3-[4-(trifluoromethyl)phenyl]propanamide
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| Structure |
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| Formula |
C25H27F3N2O
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| Molecular Weight |
428.498
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| Canonical SMILES |
CN(C)CCC(NC(=O)CCc1ccc(cc1)C(F)(F)F)c1ccc2ccccc2c1
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| InChI |
InChI=1S/C25H27F3N2O/c1-30(2)16-15-23(21-11-10-19-5-3-4-6-20(19)17-21)29-24(31)14-9-18-7-12-22(13-8-18)25(26,27)28/h3-8,10-13,17,23H,9,14-16H2,1-2H3,(H,29,31)
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| InChIKey |
UKQYUZDXTPCKEO-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