General Information of the Compound
| Compound ID |
CP0448876
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| Compound Name |
N-[1-(3,3-diphenylpropyl)piperidin-4-yl]-N-methyl-2-(2,4,5-trimethoxyphenyl)acetamide
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| Structure |
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| Formula |
C32H40N2O4
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| Molecular Weight |
516.682
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| Canonical SMILES |
COc1cc(OC)c(OC)cc1CC(=O)N(C)C1CCN(CCC(c2ccccc2)c2ccccc2)CC1
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| InChI |
InChI=1S/C32H40N2O4/c1-33(32(35)22-26-21-30(37-3)31(38-4)23-29(26)36-2)27-15-18-34(19-16-27)20-17-28(24-11-7-5-8-12-24)25-13-9-6-10-14-25/h5-14,21,23,27-28H,15-20,22H2,1-4H3
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| InChIKey |
WKSITDKVPYKIGT-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