General Information of the Compound
| Compound ID |
CP0568751
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| Compound Name |
2,6-dimethyl-N-[(2-methyl-2-azabicyclo[2.2.2]octan-1-yl)-[3-(1-methylpyrazol-4-yl)phenyl]methyl]benzamide
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| Structure |
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| Formula |
C28H34N4O
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| Molecular Weight |
442.607
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| Canonical SMILES |
CN1CC2CCC1(CC2)C(NC(=O)c1c(C)cccc1C)c1cccc(c1)-c1cnn(C)c1
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| InChI |
InChI=1S/C28H34N4O/c1-19-7-5-8-20(2)25(19)27(33)30-26(28-13-11-21(12-14-28)17-31(28)3)23-10-6-9-22(15-23)24-16-29-32(4)18-24/h5-10,15-16,18,21,26H,11-14,17H2,1-4H3,(H,30,33)
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| InChIKey |
LATPANDAAPVGDM-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