Physical Properties | | | |
Molecular Weight: 450.485 g/mol | logS: -5.8187 | SlogP: 5.136 | Reactive groups: 0 |
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Topological Properties | | | |
Globularity: 0.0789859 | Sterimol/B1: 2.49187 | Sterimol/B2: 5.32395 | Sterimol/B3: 5.74399 |
Sterimol/B4: 6.11273 | Sterimol/L: 20.8318 | | | |
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Surface and Volume Properties | | | |
Accessible surface: 711.12 | Positive charged surface: 440.649 | Negative charged surface: 270.471 | Volume: 416.75 |
Hydrophobic surface: 642.573 | Hydrophilic surface: 68.547 | | |
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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: 0 | |