Physical Properties | | | |
Molecular Weight: 412.525 g/mol | logS: -4.68477 | SlogP: 1.4059 | Reactive groups: 0 |
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Topological Properties | | | |
Globularity: 0.253647 | Sterimol/B1: 2.22814 | Sterimol/B2: 4.0304 | Sterimol/B3: 4.90395 |
Sterimol/B4: 9.53712 | Sterimol/L: 14.4875 | | | |
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Surface and Volume Properties | | | |
Accessible surface: 618.26 | Positive charged surface: 416.258 | Negative charged surface: 202.002 | Volume: 387.625 |
Hydrophobic surface: 460.148 | Hydrophilic surface: 158.112 | | |
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Pharmacophoric Properties | | | |
Hydrogen bond donors: 0 | Hydrogen bond acceptors: 2 | 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 | |