General Information of the Compound
| Compound ID |
CP0408992
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| Compound Name |
3-(1-methylpiperidin-4-yl)oxy-N-[(3-propan-2-yl-1,2-oxazol-5-yl)methyl]-4-(trifluoromethyl)benzamide
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| Structure |
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| Formula |
C21H26F3N3O3
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| Molecular Weight |
425.451
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| Canonical SMILES |
CC(C)c1cc(CNC(=O)c2ccc(c(OC3CCN(C)CC3)c2)C(F)(F)F)on1
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| InChI |
InChI=1S/C21H26F3N3O3/c1-13(2)18-11-16(30-26-18)12-25-20(28)14-4-5-17(21(22,23)24)19(10-14)29-15-6-8-27(3)9-7-15/h4-5,10-11,13,15H,6-9,12H2,1-3H3,(H,25,28)
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| InChIKey |
AFQZDXASSBDZIH-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