Question stringlengths 559 1.03k | Answer stringclasses 2
values | TargetMolecule stringlengths 19 198 | SampleMethod stringclasses 1
value | SampleNum int64 2 2 | SampleRep stringclasses 1
value | image imagewidth (px) 300 300 |
|---|---|---|---|---|---|---|
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge.
Task Description:
Given the Smiles string and molecular properties above, predict whether this molecule can inhibit (Yes) the Beta-site Amyloid Precursor Protein Cleaving Enzyme 1... | <boolean>Yes</boolean> | S1(=O)(=O)CC(Cc2cc(OC(C(F)(F)F)C(F)(F)F)c(N)c(F)c2)C(O)C([NH2+]Cc2noc(c2)CC(C)(C)C)C1 | scaffold | 2 | smiles | |
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge.
Task Description:
Given the Smiles string and molecular properties above, predict whether this molecule can inhibit (Yes) the Beta-site Amyloid Precursor Protein Cleaving Enzyme 1... | <boolean>No</boolean> | O1[C@@H]2COCC[C@@]2(N=C1N)c1cc(ccc1)-c1cncnc1 | scaffold | 2 | smiles | |
You are an expert chemist, your task is to predict the property of molecule using your experienced chemical property prediction knowledge.
Task Description:
Given the Smiles string and molecular properties above, predict whether this molecule can inhibit (Yes) the Beta-site Amyloid Precursor Protein Cleaving Enzyme 1... | <boolean>No</boolean> | O=C1N(C)C(=NC(=C1)[C@H]1C[C@H]1c1ccccc1)N | scaffold | 2 | smiles |
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