dihexa predicted pka Table 1 from Prediction of Values for Aliphatic Carboxylic Acids and Alcohols with Empirical Atomic Charge Descriptors Dihexa (PNB-0408)
Dihexa (PNB 0408) Dihexa 1401708 83 5 BGC70883 Biosynth Open source QSAR models for pKa prediction using multiple machine learning approaches Journal of Cheminformatics Springer Nature Link pKa prediction in nonaqueous solvents Zheng 2025 Journal of Computational Chemistry Wiley Online Library
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