Physical Properties | | | |
Molecular Weight: 547.672 g/mol | logS: -9.11265 | SlogP: 5.53721 | Reactive groups: 0 |
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Topological Properties | | | |
Globularity: 0.129513 | Sterimol/B1: 2.45478 | Sterimol/B2: 3.25093 | Sterimol/B3: 5.53547 |
Sterimol/B4: 10.8629 | Sterimol/L: 18.288 | | | |
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Surface and Volume Properties | | | |
Accessible surface: 801.754 | Positive charged surface: 464.148 | Negative charged surface: 337.605 | Volume: 512.875 |
Hydrophobic surface: 651.316 | Hydrophilic surface: 150.438 | | |
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Pharmacophoric Properties | | | |
Hydrogen bond donors: 1 | Hydrogen bond acceptors: 4 | Acid groups: 0 | Basic groups: 0 |
Chiral centers: 2 | | | |
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Drug- and Lead-like Properties | | | |
Lipinski's drug-like rule: 0 | Violations of Lipinski's rule: 2 | Oprea's lead like rule: 0 | |