jiahborcn/chembl_aqsol

该数据集包含化学分子的相关信息，主要特征包括Molecule ChEMBL ID、Smiles、Standard Relation、Standard Value、Standard Units、Assay Description、standardized_smiles和logS。数据集分为一个训练集，包含27516个样本，文件大小为7179250字节。下载大小为2559929字节。This dataset contains information about chemical molecules, with key features including Molecule ChEMBL ID, Smiles, Standard Relation, Standard Value, Standard Units, Assay Description, standardized_smiles, and logS. The dataset is divided into one training set containing 27516 samples, with a file size of 7179250 bytes. The download size is 2559929 bytes.