General Information of the Compound
| Compound ID |
CP0533381
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| Compound Name |
2-ethoxy-N-[1-[2-(2-propan-2-ylphenoxy)ethyl]pyrrolidin-3-yl]benzamide
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| Structure |
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| Formula |
C24H32N2O3
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| Molecular Weight |
396.531
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| Canonical SMILES |
CCOc1ccccc1C(=O)NC1CCN(CCOc2ccccc2C(C)C)C1
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| InChI |
InChI=1S/C24H32N2O3/c1-4-28-23-12-8-6-10-21(23)24(27)25-19-13-14-26(17-19)15-16-29-22-11-7-5-9-20(22)18(2)3/h5-12,18-19H,4,13-17H2,1-3H3,(H,25,27)
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| InChIKey |
HQDFVBNAAKOTJK-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