Physical Properties | | | |
Molecular Weight: 413.521 g/mol | logS: -4.97651 | SlogP: 5.2742 | Reactive groups: 0 |
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Topological Properties | | | |
Globularity: 0.103505 | Sterimol/B1: 2.69847 | Sterimol/B2: 3.91156 | Sterimol/B3: 5.27404 |
Sterimol/B4: 9.88071 | Sterimol/L: 19.511 | | | |
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Surface and Volume Properties | | | |
Accessible surface: 732.587 | Positive charged surface: 471.988 | Negative charged surface: 260.599 | Volume: 418.625 |
Hydrophobic surface: 660.414 | Hydrophilic surface: 72.173 | | |
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Pharmacophoric Properties | | | |
Hydrogen bond donors: 1 | Hydrogen bond acceptors: 3 | Acid groups: 0 | Basic groups: 0 |
Chiral centers: 2 | | | |
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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 | |