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Secondary Amines Formal Charge 3
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| Molecule | CAT_NO | Molecular_Weight | LogP | DONORS | ACCEPTORS | ROTATION_BONDS | LIPINSKI | pKa | Site_Name | FormalCharge | druglike | Autodock kcal/mol | XScore pKd | Index |
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R288802 | 162.30 | -0.67 | 3 | 0 | 8 | 4 | 7.42 9.48 9.48 | AmineSecondary AmineSecondary AmineSecondary | 3 | 3.26 | -6.11 | 4.52 | 1 |
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R648604 | 410.62 | 6.89 | 1 | 0 | 9 | 2 | 2.19 2.21 8.2 8.2 8.26 | Imine Imine AmineTertiary AmineTertiary AmineSecondary | 3 | -0.11 | -6.61 | 4.32 | 2 |
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