General Information of the Compound
| Compound ID |
CP0430623
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| Compound Name |
2-methoxy-N-[[4-piperidin-1-yl-3-(trifluoromethyl)phenyl]carbamoyl]benzamide
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| Structure |
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| Formula |
C21H22F3N3O3
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| Molecular Weight |
421.419
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| Canonical SMILES |
COc1ccccc1C(=O)NC(=O)Nc1ccc(N2CCCCC2)c(c1)C(F)(F)F
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| InChI |
InChI=1S/C21H22F3N3O3/c1-30-18-8-4-3-7-15(18)19(28)26-20(29)25-14-9-10-17(16(13-14)21(22,23)24)27-11-5-2-6-12-27/h3-4,7-10,13H,2,5-6,11-12H2,1H3,(H2,25,26,28,29)
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| InChIKey |
ZUFGPXRNQYMRFT-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