General Information of the Compound
| Compound ID |
CP0334693
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| Compound Name |
4-((1-(benzo[d][1,3]dioxol-5-ylmethyl)piperidin-4-yl)methyl)-N-(2-phenylpropyl)benzamide
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| Structure |
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| Formula |
C30H34N2O3
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| Molecular Weight |
470.613
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| Canonical SMILES |
CC(CNC(=O)c1ccc(CC2CCN(Cc3ccc4OCOc4c3)CC2)cc1)c1ccccc1
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| InChI |
InChI=1S/C30H34N2O3/c1-22(26-5-3-2-4-6-26)19-31-30(33)27-10-7-23(8-11-27)17-24-13-15-32(16-14-24)20-25-9-12-28-29(18-25)35-21-34-28/h2-12,18,22,24H,13-17,19-21H2,1H3,(H,31,33)
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| InChIKey |
FEELMJWVBBMMQE-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