Physical Properties | | | |
Molecular Weight: 413.439 g/mol | logS: -6.70865 | SlogP: 6.2941 | Reactive groups: 0 |
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Topological Properties | | | |
Globularity: 0.27972 | Sterimol/B1: 3.8551 | Sterimol/B2: 3.88671 | Sterimol/B3: 5.94946 |
Sterimol/B4: 7.46125 | Sterimol/L: 14.9406 | | | |
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Surface and Volume Properties | | | |
Accessible surface: 609.469 | Positive charged surface: 306.982 | Negative charged surface: 295.184 | Volume: 371.875 |
Hydrophobic surface: 435.964 | Hydrophilic surface: 173.505 | | |
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Pharmacophoric Properties | | | |
Hydrogen bond donors: 2 | 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 | |