Physical Properties | | | |
Molecular Weight: 412.638 g/mol | logS: -6.04804 | SlogP: 5.06887 | Reactive groups: 0 |
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Topological Properties | | | |
Globularity: 0.0686085 | Sterimol/B1: 2.37283 | Sterimol/B2: 3.60903 | Sterimol/B3: 4.57458 |
Sterimol/B4: 10.7686 | Sterimol/L: 18.7184 | | | |
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Surface and Volume Properties | | | |
Accessible surface: 723.862 | Positive charged surface: 555.058 | Negative charged surface: 168.803 | Volume: 450.25 |
Hydrophobic surface: 587.198 | Hydrophilic surface: 136.664 | | |
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Pharmacophoric Properties | | | |
Hydrogen bond donors: 1 | Hydrogen bond acceptors: 2 | Acid groups: 0 | Basic groups: 1 |
Chiral centers: 4 | | | |
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Drug- and Lead-like Properties | | | |
Lipinski's drug-like rule: 1 | Violations of Lipinski's rule: 1 | Oprea's lead like rule: 1 | |