General Information of the Compound
| Compound ID |
CP0525851
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| Compound Name |
2-(4-Benzyloxy-phenyl)-N-[1-(3,3-diphenyl-propyl)-piperidin-4-yl]-N-methyl-acetamide
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| Structure |
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| Formula |
C36H40N2O2
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| Molecular Weight |
532.728
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| Canonical SMILES |
CN(C1CCN(CCC(c2ccccc2)c2ccccc2)CC1)C(=O)Cc1ccc(OCc2ccccc2)cc1
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| InChI |
InChI=1S/C36H40N2O2/c1-37(36(39)27-29-17-19-34(20-18-29)40-28-30-11-5-2-6-12-30)33-21-24-38(25-22-33)26-23-35(31-13-7-3-8-14-31)32-15-9-4-10-16-32/h2-20,33,35H,21-28H2,1H3
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| InChIKey |
QFLYWGKASFLQGC-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