Physical Properties | | | |
Molecular Weight: 411.522 g/mol | logS: -4.27662 | SlogP: 3.18242 | Reactive groups: 0 |
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Topological Properties | | | |
Globularity: 0.0253591 | Sterimol/B1: 2.53915 | Sterimol/B2: 2.93505 | Sterimol/B3: 4.61665 |
Sterimol/B4: 9.58441 | Sterimol/L: 20.8708 | | | |
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Surface and Volume Properties | | | |
Accessible surface: 762.333 | Positive charged surface: 526.201 | Negative charged surface: 229.876 | Volume: 421.125 |
Hydrophobic surface: 638.176 | Hydrophilic surface: 124.157 | | |
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Pharmacophoric Properties | | | |
Hydrogen bond donors: 1 | Hydrogen bond acceptors: 3 | Acid groups: 0 | Basic groups: 1 |
Chiral centers: 2 | | | |
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Drug- and Lead-like Properties | | | |
Lipinski's drug-like rule: 1 | Violations of Lipinski's rule: 0 | Oprea's lead like rule: 1 | |