Physical Properties | | | |
Molecular Weight: 450.583 g/mol | logS: -6.0708 | SlogP: 2.27 | Reactive groups: 0 |
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Topological Properties | | | |
Globularity: 0.0970965 | Sterimol/B1: 4.23619 | Sterimol/B2: 4.48026 | Sterimol/B3: 5.36695 |
Sterimol/B4: 6.71557 | Sterimol/L: 16.82 | | | |
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Surface and Volume Properties | | | |
Accessible surface: 702.02 | Positive charged surface: 426.288 | Negative charged surface: 274.636 | Volume: 438 |
Hydrophobic surface: 592.168 | Hydrophilic surface: 109.852 | | |
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Pharmacophoric Properties | | | |
Hydrogen bond donors: 1 | Hydrogen bond acceptors: 3 | Acid groups: 0 | Basic groups: 1 |
Chiral centers: 1 | | | |
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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 | |