Physical Properties | | | |
Molecular Weight: 461.606 g/mol | logS: -4.67795 | SlogP: 4.35977 | Reactive groups: 0 |
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Topological Properties | | | |
Globularity: 0.3438 | Sterimol/B1: 3.40952 | Sterimol/B2: 4.75899 | Sterimol/B3: 6.08468 |
Sterimol/B4: 7.79803 | Sterimol/L: 14.7213 | | | |
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Surface and Volume Properties | | | |
Accessible surface: 695.208 | Positive charged surface: 566.153 | Negative charged surface: 129.055 | Volume: 458.875 |
Hydrophobic surface: 663.64 | Hydrophilic surface: 31.568 | | |
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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: 0 | Oprea's lead like rule: 1 | |