dihexa predicted pka prediction using quantum mechanics and machine learning Dihexa | 1401708-83-5 | BGC70883
Dihexa 1401708 83 5 BGC70883 Biosynth pKa prediction in nonaqueous solvents Zheng 2025 Journal of Computational Chemistry Wiley Online Library Phenol Substituents and Their Observed and Predicted pKa Values Download Scientific Diagram What pka would you guys estimate and why? I don't know if I should be using the pka of 11 or 36 for molecules with NH2. I thinkI was made aware of Compounds considered for theoretical pKa calculation Download Scientific Diagram
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