id stringlengths 15 190 | task stringclasses 1
value | answer stringclasses 4
values | correct_molecule stringlengths 5 149 | options listlengths 4 4 | options_logka listlengths 4 4 | host_name stringclasses 131
values | version stringclasses 1
value | question stringlengths 433 1.5k | source stringclasses 2
values | prompt_strategy stringclasses 1
value |
|---|---|---|---|---|---|---|---|---|---|---|
t2_p-Sulfonatocalix[6]arene_29 | task2 | A | Phenyltrimethylammonium | [
"Phenyltrimethylammonium",
"2,3-Diazabicyclo(2.2.2)oct-2-ene",
"Arginyl-arginyl-arginine",
"Cobalt(2+)"
] | [
4.4997,
1.9138,
3.2041,
3.7543
] | p-Sulfonatocalix[6]arene | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-Sulfonatocalix[6]arene (SMILES: C1C2=CC(=CC(=C2O)CC3=CC(=CC(=C3O)CC4=CC(=CC(=C4O)CC5=C(C(=CC(=C5)S(=O... | eupmc | base |
t2_p-Sulfonatocalix[6]arene_30 | task2 | D | Auramine O | [
"6,7-diazabicyclo(3.2.2)non-6-ene",
"D/L-Tryptophan",
"Arginylarginine",
"Auramine O"
] | [
1.1206,
3.1608,
3.0792,
4.0934
] | p-Sulfonatocalix[6]arene | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-Sulfonatocalix[6]arene (SMILES: C1C2=CC(=CC(=C2O)CC3=CC(=CC(=C3O)CC4=CC(=CC(=C4O)CC5=C(C(=CC(=C5)S(=O... | eupmc | base |
t2_p-Sulfonatocalix[6]arene_31 | task2 | B | Methylene Blue | [
"D/L-Alanine",
"Methylene Blue",
"Cobalt(2+)",
"Pinacolyl methylphosphonic acid"
] | [
1.8129,
5.8202,
3.7543,
1.9777
] | p-Sulfonatocalix[6]arene | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-Sulfonatocalix[6]arene (SMILES: C1C2=CC(=CC(=C2O)CC3=CC(=CC(=C3O)CC4=CC(=CC(=C4O)CC5=C(C(=CC(=C5)S(=O... | eupmc | base |
t2_p-Sulfonatocalix[6]arene_32 | task2 | D | Baicalin | [
"N6-Trimethyllysine",
"trans-Ferulic acid",
"Glycine",
"Baicalin"
] | [
2.9689,
3.9902,
1.2304,
4.2722
] | p-Sulfonatocalix[6]arene | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-Sulfonatocalix[6]arene (SMILES: C1C2=CC(=CC(=C2O)CC3=CC(=CC(=C3O)CC4=CC(=CC(=C4O)CC5=C(C(=CC(=C5)S(=O... | eupmc | base |
t2_p-Sulfonatocalix[6]arene_33 | task2 | C | Berberine chloride | [
"Benzyltrimethylammonium",
"Soman",
"Berberine chloride",
"lysyllysine"
] | [
0.6628,
1,
3.96,
3.3617
] | p-Sulfonatocalix[6]arene | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-Sulfonatocalix[6]arene (SMILES: C1C2=CC(=CC(=C2O)CC3=CC(=CC(=C3O)CC4=CC(=CC(=C4O)CC5=C(C(=CC(=C5)S(=O... | eupmc | base |
t2_p-Sulfonatocalix[6]arene_34 | task2 | C | Fluorescein | [
"2,3-Diazabicyclo(2.2.2)oct-2-ene",
"Soman",
"Fluorescein",
"lysyllysine"
] | [
1.9138,
1,
3.7839,
3.3617
] | p-Sulfonatocalix[6]arene | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-Sulfonatocalix[6]arene (SMILES: C1C2=CC(=CC(=C2O)CC3=CC(=CC(=C3O)CC4=CC(=CC(=C4O)CC5=C(C(=CC(=C5)S(=O... | eupmc | base |
t2_p-Sulfonatocalix[6]arene_35 | task2 | A | Insulin Human | [
"Insulin Human",
"Benzyltrimethylammonium",
"N6-Trimethyllysine",
"Cobalt(2+)"
] | [
5,
0.6628,
2.9689,
3.7543
] | p-Sulfonatocalix[6]arene | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-Sulfonatocalix[6]arene (SMILES: C1C2=CC(=CC(=C2O)CC3=CC(=CC(=C3O)CC4=CC(=CC(=C4O)CC5=C(C(=CC(=C5)S(=O... | eupmc | base |
t2_p-Sulfonatocalix[6]arene_36 | task2 | B | Benzyltriethylammonium | [
"L-Arginine",
"Benzyltriethylammonium",
"Zinc cation",
"2-nitrobenzylmethylethercholine"
] | [
2.1202,
4.8,
3.847,
4.1139
] | p-Sulfonatocalix[6]arene | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-Sulfonatocalix[6]arene (SMILES: C1C2=CC(=CC(=C2O)CC3=CC(=CC(=C3O)CC4=CC(=CC(=C4O)CC5=C(C(=CC(=C5)S(=O... | eupmc | base |
t2_p-Sulfonatocalix[6]arene_37 | task2 | C | Norfloxacin | [
"Acridine red",
"6,7-diazabicyclo(3.2.2)non-6-ene",
"Norfloxacin",
"Cyclopentanone"
] | [
3.98,
1.1206,
4.6016,
3.5465
] | p-Sulfonatocalix[6]arene | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-Sulfonatocalix[6]arene (SMILES: C1C2=CC(=CC(=C2O)CC3=CC(=CC(=C3O)CC4=CC(=CC(=C4O)CC5=C(C(=CC(=C5)S(=O... | eupmc | base |
t2_p-Sulfonatocalix[6]arene_38 | task2 | D | 4-[(E)-2-(3,10a-dihydropyren-1-yl)vinyl]-1-methyl-pyridine | [
"2,3-Diazabicyclo[2.2.1]-hept-2-ene",
"N6-Trimethyllysine",
"D/L-Serine",
"4-[(E)-2-(3,10a-dihydropyren-1-yl)vinyl]-1-methyl-pyridine"
] | [
1.7419,
2.9689,
2.0492,
3.76
] | p-Sulfonatocalix[6]arene | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-Sulfonatocalix[6]arene (SMILES: C1C2=CC(=CC(=C2O)CC3=CC(=CC(=C3O)CC4=CC(=CC(=C4O)CC5=C(C(=CC(=C5)S(=O... | eupmc | base |
t2_p-Sulfonatocalix[6]arene_39 | task2 | D | Benzyltriethylammonium | [
"Glycine",
"2,3-Diazabicyclo(2.2.2)oct-2-ene",
"Benzyltrimethylammonium",
"Benzyltriethylammonium"
] | [
1.2304,
1.9138,
0.6628,
4.8
] | p-Sulfonatocalix[6]arene | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-Sulfonatocalix[6]arene (SMILES: C1C2=CC(=CC(=C2O)CC3=CC(=CC(=C3O)CC4=CC(=CC(=C4O)CC5=C(C(=CC(=C5)S(=O... | eupmc | base |
t2_p-Sulfonatocalix[6]arene_40 | task2 | C | Benzyltriethylammonium | [
"asymmetric N,N-dimethylarginine",
"D/L-Tryptophan",
"Benzyltriethylammonium",
"Acridine red"
] | [
2.4983,
3.1608,
4.8,
3.98
] | p-Sulfonatocalix[6]arene | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-Sulfonatocalix[6]arene (SMILES: C1C2=CC(=CC(=C2O)CC3=CC(=CC(=C3O)CC4=CC(=CC(=C4O)CC5=C(C(=CC(=C5)S(=O... | eupmc | base |
t2_p-Sulfonatocalix[6]arene_41 | task2 | C | Methylene Blue | [
"N-methyl-N-(4-(2-(1-methylpyridin-4(1H)-ylidene)ethylidene)cyclohexa-2,5-dien-1-ylidene)methanaminium",
"D/L-Proline",
"Methylene Blue",
"Soman"
] | [
5,
2.2304,
5.8202,
1
] | p-Sulfonatocalix[6]arene | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-Sulfonatocalix[6]arene (SMILES: C1C2=CC(=CC(=C2O)CC3=CC(=CC(=C3O)CC4=CC(=CC(=C4O)CC5=C(C(=CC(=C5)S(=O... | eupmc | base |
t2_p-Sulfonatocalix[6]arene_42 | task2 | D | [Amino-[4-[6-[amino(azaniumylidene)methyl]-1H-indol-2-yl]phenyl]methylidene]azanium | [
"Tetramethylammonium",
"Auramine O",
"Tetraethylammonium iodide",
"[Amino-[4-[6-[amino(azaniumylidene)methyl]-1H-indol-2-yl]phenyl]methylidene]azanium"
] | [
4.8998,
4.0934,
5,
5.9494
] | p-Sulfonatocalix[6]arene | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-Sulfonatocalix[6]arene (SMILES: C1C2=CC(=CC(=C2O)CC3=CC(=CC(=C3O)CC4=CC(=CC(=C4O)CC5=C(C(=CC(=C5)S(=O... | eupmc | base |
t2_p-Sulfonatocalix[6]arene_43 | task2 | D | N-methyl-N-(4-(2-(1-methylpyridin-4(1H)-ylidene)ethylidene)cyclohexa-2,5-dien-1-ylidene)methanaminium | [
"Benzyltrimethylammonium",
"Zinc cation",
"Norfloxacin",
"N-methyl-N-(4-(2-(1-methylpyridin-4(1H)-ylidene)ethylidene)cyclohexa-2,5-dien-1-ylidene)methanaminium"
] | [
0.6628,
3.847,
4.6016,
5
] | p-Sulfonatocalix[6]arene | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-Sulfonatocalix[6]arene (SMILES: C1C2=CC(=CC(=C2O)CC3=CC(=CC(=C3O)CC4=CC(=CC(=C4O)CC5=C(C(=CC(=C5)S(=O... | eupmc | base |
t2_p-Sulfonatocalix[6]arene_44 | task2 | C | Tetrapropylammonium chloride | [
"2,3-Diazabicyclo[2.2.1]-hept-2-ene",
"Arginyl-arginyl-arginine",
"Tetrapropylammonium chloride",
"Tetrabutylammonium iodide"
] | [
1.7419,
3.2041,
4.1987,
3.2
] | p-Sulfonatocalix[6]arene | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-Sulfonatocalix[6]arene (SMILES: C1C2=CC(=CC(=C2O)CC3=CC(=CC(=C3O)CC4=CC(=CC(=C4O)CC5=C(C(=CC(=C5)S(=O... | eupmc | base |
t2_p-Sulfonatocalix[6]arene_45 | task2 | B | N-methyl-N-(4-(2-(1-methylpyridin-4(1H)-ylidene)ethylidene)cyclohexa-2,5-dien-1-ylidene)methanaminium | [
"Lysyllysyllysine",
"N-methyl-N-(4-(2-(1-methylpyridin-4(1H)-ylidene)ethylidene)cyclohexa-2,5-dien-1-ylidene)methanaminium",
"Zinc cation",
"Nickel(2+)"
] | [
3.4914,
5,
3.847,
3.7316
] | p-Sulfonatocalix[6]arene | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-Sulfonatocalix[6]arene (SMILES: C1C2=CC(=CC(=C2O)CC3=CC(=CC(=C3O)CC4=CC(=CC(=C4O)CC5=C(C(=CC(=C5)S(=O... | eupmc | base |
t2_p-Sulfonatocalix[6]arene_46 | task2 | D | Choline | [
"Pinacolyl methylphosphonic acid",
"N6-Trimethyllysine",
"D/L-Alanine",
"Choline"
] | [
1.9777,
2.9689,
1.8129,
4.8
] | p-Sulfonatocalix[6]arene | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-Sulfonatocalix[6]arene (SMILES: C1C2=CC(=CC(=C2O)CC3=CC(=CC(=C3O)CC4=CC(=CC(=C4O)CC5=C(C(=CC(=C5)S(=O... | eupmc | base |
t2_p-Sulfonatocalix[6]arene_47 | task2 | B | Phenyltrimethylammonium | [
"D/L-histidine",
"Phenyltrimethylammonium",
"Benzyltrimethylammonium",
"Auramine O"
] | [
3.2856,
4.4997,
0.6628,
4.0934
] | p-Sulfonatocalix[6]arene | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-Sulfonatocalix[6]arene (SMILES: C1C2=CC(=CC(=C2O)CC3=CC(=CC(=C3O)CC4=CC(=CC(=C4O)CC5=C(C(=CC(=C5)S(=O... | eupmc | base |
t2_p-Sulfonatocalix[6]arene_48 | task2 | C | Neutral Red protonated | [
"Cobalt(2+)",
"Zinc cation",
"Neutral Red protonated",
"D/L-phenylalanine"
] | [
3.7543,
3.847,
4.4254,
2.5821
] | p-Sulfonatocalix[6]arene | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-Sulfonatocalix[6]arene (SMILES: C1C2=CC(=CC(=C2O)CC3=CC(=CC(=C3O)CC4=CC(=CC(=C4O)CC5=C(C(=CC(=C5)S(=O... | eupmc | base |
t2_p-Sulfonatocalix[6]arene_49 | task2 | B | Methylene Blue | [
"Tetrabutylammonium iodide",
"Methylene Blue",
"Soman",
"L-Arginine"
] | [
3.2,
5.8202,
1,
2.1202
] | p-Sulfonatocalix[6]arene | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-Sulfonatocalix[6]arene (SMILES: C1C2=CC(=CC(=C2O)CC3=CC(=CC(=C3O)CC4=CC(=CC(=C4O)CC5=C(C(=CC(=C5)S(=O... | eupmc | base |
t2_p-Sulfonatocalix[6]arene_50 | task2 | C | Norfloxacin | [
"D/L-Alanine",
"D/L-phenylalanine",
"Norfloxacin",
"Soman"
] | [
1.8129,
2.5821,
4.6016,
1
] | p-Sulfonatocalix[6]arene | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-Sulfonatocalix[6]arene (SMILES: C1C2=CC(=CC(=C2O)CC3=CC(=CC(=C3O)CC4=CC(=CC(=C4O)CC5=C(C(=CC(=C5)S(=O... | eupmc | base |
t2_p-Sulfonatocalix[6]arene_51 | task2 | C | Tetraethylammonium iodide | [
"Butyl Rhodamine B",
"Nickel(2+)",
"Tetraethylammonium iodide",
"D/L-Serine"
] | [
4.4781,
3.7316,
5,
2.0492
] | p-Sulfonatocalix[6]arene | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-Sulfonatocalix[6]arene (SMILES: C1C2=CC(=CC(=C2O)CC3=CC(=CC(=C3O)CC4=CC(=CC(=C4O)CC5=C(C(=CC(=C5)S(=O... | eupmc | base |
t2_p-Sulfonatocalix[6]arene_52 | task2 | D | Neutral Red protonated | [
"Copper cation",
"L-Arginine",
"trans-Ferulic acid",
"Neutral Red protonated"
] | [
4.143,
2.1202,
3.9902,
4.4254
] | p-Sulfonatocalix[6]arene | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-Sulfonatocalix[6]arene (SMILES: C1C2=CC(=CC(=C2O)CC3=CC(=CC(=C3O)CC4=CC(=CC(=C4O)CC5=C(C(=CC(=C5)S(=O... | eupmc | base |
t2_p-Sulfonatocalix[6]arene_53 | task2 | B | Zinc cation | [
"2,3-Diazabicyclo(2.2.2)oct-2-ene",
"Zinc cation",
"asymmetric N,N-dimethylarginine",
"lysyllysine"
] | [
1.9138,
3.847,
2.4983,
3.3617
] | p-Sulfonatocalix[6]arene | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-Sulfonatocalix[6]arene (SMILES: C1C2=CC(=CC(=C2O)CC3=CC(=CC(=C3O)CC4=CC(=CC(=C4O)CC5=C(C(=CC(=C5)S(=O... | eupmc | base |
t2_p-Sulfonatocalix[6]arene_54 | task2 | A | Butyl Rhodamine B | [
"Butyl Rhodamine B",
"Neutral Red protonated",
"Symmetric-N,N-dimethylarginine",
"N6-Trimethyllysine"
] | [
4.4781,
4.4254,
3.1004,
2.9689
] | p-Sulfonatocalix[6]arene | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-Sulfonatocalix[6]arene (SMILES: C1C2=CC(=CC(=C2O)CC3=CC(=CC(=C3O)CC4=CC(=CC(=C4O)CC5=C(C(=CC(=C5)S(=O... | eupmc | base |
t2_p-Sulfonatocalix[6]arene_55 | task2 | C | N-methyl-N-(4-(2-(1-methylpyridin-4(1H)-ylidene)ethylidene)cyclohexa-2,5-dien-1-ylidene)methanaminium | [
"Nickel(2+)",
"D/L-Leucine",
"N-methyl-N-(4-(2-(1-methylpyridin-4(1H)-ylidene)ethylidene)cyclohexa-2,5-dien-1-ylidene)methanaminium",
"Cobalt(2+)"
] | [
3.7316,
2.5391,
5,
3.7543
] | p-Sulfonatocalix[6]arene | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-Sulfonatocalix[6]arene (SMILES: C1C2=CC(=CC(=C2O)CC3=CC(=CC(=C3O)CC4=CC(=CC(=C4O)CC5=C(C(=CC(=C5)S(=O... | eupmc | base |
t2_p-Sulfonatothiacalix[4]arene_0 | task2 | C | 2-Aminopyridine | [
"1,4-Diazepane",
"4,4'-Bipyridine",
"2-Aminopyridine",
"2,6-pyridinedicarboxylic acid"
] | [
2.4691,
1.6902,
2.7185,
1.8261
] | p-Sulfonatothiacalix[4]arene | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-Sulfonatothiacalix[4]arene in aqueous solution at standard conditions?
A. 1,4-Diazepane (SMILES: C1C... | eupmc | base |
t2_p-Sulfonatothiacalix[4]arene_1 | task2 | A | Cinchonidine | [
"Cinchonidine",
"1,4-Diazepane",
"2-Chloropyridine",
"4-Aminopyridine"
] | [
4.1434,
2.4691,
2.1523,
2.4654
] | p-Sulfonatothiacalix[4]arene | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-Sulfonatothiacalix[4]arene in aqueous solution at standard conditions?
A. Cinchonidine (SMILES: [H][... | eupmc | base |
t2_p-Sulfonatothiacalix[4]arene_2 | task2 | C | Benzyltrimethylammonium chloride | [
"1,5-diazacyclooctane",
"2,2'-bipyridine",
"Benzyltrimethylammonium chloride",
"1,4-Diazepane"
] | [
2.5391,
1.7559,
3.27,
2.4691
] | p-Sulfonatothiacalix[4]arene | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-Sulfonatothiacalix[4]arene in aqueous solution at standard conditions?
A. 1,5-diazacyclooctane (SMIL... | eupmc | base |
t2_p-Sulfonatothiacalix[4]arene_3 | task2 | B | 2-Aminopyridine | [
"4-methylpyridine",
"2-Aminopyridine",
"4,4'-Bipyridine",
"1,5-diazacyclooctane"
] | [
2.4638,
2.7185,
1.6902,
2.5391
] | p-Sulfonatothiacalix[4]arene | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-Sulfonatothiacalix[4]arene in aqueous solution at standard conditions?
A. 4-methylpyridine (SMILES: ... | eupmc | base |
t2_p-Sulfonatothiacalix[4]arene_4 | task2 | D | 2-Aminopyridine | [
"2,2'-bipyridine",
"4-Aminopyridine",
"Trimethylglycine",
"2-Aminopyridine"
] | [
1.7559,
2.4654,
1.0792,
2.7185
] | p-Sulfonatothiacalix[4]arene | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-Sulfonatothiacalix[4]arene in aqueous solution at standard conditions?
A. 2,2'-bipyridine (SMILES: C... | eupmc | base |
t2_p-Sulfonatothiacalix[4]arene_5 | task2 | D | 2-Aminopyridine | [
"1,4-Diazepane",
"2,6-pyridinedicarboxylic acid",
"Trimethylglycine",
"2-Aminopyridine"
] | [
2.4691,
1.8261,
1.0792,
2.7185
] | p-Sulfonatothiacalix[4]arene | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-Sulfonatothiacalix[4]arene in aqueous solution at standard conditions?
A. 1,4-Diazepane (SMILES: C1C... | eupmc | base |
t2_p-Sulfonatothiacalix[4]arene_6 | task2 | D | Cinchonidine | [
"2-methylpyridine",
"4-methylpyridine",
"2,2'-bipyridine",
"Cinchonidine"
] | [
2.6916,
2.4638,
1.7559,
4.1434
] | p-Sulfonatothiacalix[4]arene | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-Sulfonatothiacalix[4]arene in aqueous solution at standard conditions?
A. 2-methylpyridine.
B. 4-met... | eupmc | base |
t2_p-Sulfonatothiacalix[4]arene_7 | task2 | C | 1,5-diazacyclooctane | [
"2,6-pyridinedicarboxylic acid",
"Acetyl-D/L-Carnitine",
"1,5-diazacyclooctane",
"2,6-Dichloropyridine"
] | [
1.8261,
1.3222,
2.5391,
2.3655
] | p-Sulfonatothiacalix[4]arene | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-Sulfonatothiacalix[4]arene in aqueous solution at standard conditions?
A. 2,6-pyridinedicarboxylic a... | eupmc | base |
t2_p-Sulfonatothiacalix[4]arene_8 | task2 | C | 1,4-Diazepane | [
"Pyridine",
"2-Chloropyridine",
"1,4-Diazepane",
"Acetyl-D/L-Carnitine"
] | [
2.1959,
2.1523,
2.4691,
1.3222
] | p-Sulfonatothiacalix[4]arene | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-Sulfonatothiacalix[4]arene in aqueous solution at standard conditions?
A. Pyridine (SMILES: C1=CC=NC... | eupmc | base |
t2_p-Sulfonatothiacalix[4]arene_9 | task2 | C | Pyridine | [
"2-Chloropyridine",
"Acetyl-D/L-Carnitine",
"Pyridine",
"4,4'-Bipyridine"
] | [
2.1523,
1.3222,
2.1959,
1.6902
] | p-Sulfonatothiacalix[4]arene | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-Sulfonatothiacalix[4]arene in aqueous solution at standard conditions?
A. 2-Chloropyridine (SMILES: ... | eupmc | base |
t2_p-Sulfonatothiacalix[4]arene_10 | task2 | C | 2,6-dimethylpyridine | [
"Benzyltrimethylammonium chloride",
"4-Aminopyridine",
"2,6-dimethylpyridine",
"Trimethylglycine"
] | [
3.27,
2.4654,
3.3334,
1.0792
] | p-Sulfonatothiacalix[4]arene | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-Sulfonatothiacalix[4]arene in aqueous solution at standard conditions?
A. Benzyltrimethylammonium ch... | eupmc | base |
t2_p-Sulfonatothiacalix[4]arene_11 | task2 | D | Cinchonidine | [
"4-methylpyridine",
"4-Aminopyridine",
"4,4'-Bipyridine",
"Cinchonidine"
] | [
2.4638,
2.4654,
1.6902,
4.1434
] | p-Sulfonatothiacalix[4]arene | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-Sulfonatothiacalix[4]arene in aqueous solution at standard conditions?
A. 4-methylpyridine (SMILES: ... | eupmc | base |
t2_p-Sulfonatothiacalix[4]arene_12 | task2 | A | 2,6-dimethylpyridine | [
"2,6-dimethylpyridine",
"1,4-Diazepane",
"Acetylcholine",
"2,6-Dichloropyridine"
] | [
3.3334,
2.4691,
2.73,
2.3655
] | p-Sulfonatothiacalix[4]arene | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-Sulfonatothiacalix[4]arene in aqueous solution at standard conditions?
A. 2,6-dimethylpyridine (SMIL... | eupmc | base |
t2_p-Sulfonatothiacalix[4]arene_13 | task2 | C | 2,6-dimethylpyridine | [
"Pyridine",
"2-Aminopyridine",
"2,6-dimethylpyridine",
"4-Aminopyridine"
] | [
2.1959,
2.7185,
3.3334,
2.4654
] | p-Sulfonatothiacalix[4]arene | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-Sulfonatothiacalix[4]arene in aqueous solution at standard conditions?
A. Pyridine (SMILES: C1=CC=NC... | eupmc | base |
t2_p-Sulfonatothiacalix[4]arene_14 | task2 | A | Cinchonidine | [
"Cinchonidine",
"4,4'-Bipyridine",
"2-methylpyridine",
"2,6-dimethylpyridine"
] | [
4.1434,
1.6902,
2.6916,
3.3334
] | p-Sulfonatothiacalix[4]arene | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-Sulfonatothiacalix[4]arene in aqueous solution at standard conditions?
A. Cinchonidine (SMILES: [H][... | eupmc | base |
t2_p-Sulfonatothiacalix[4]arene_15 | task2 | D | 1,5-diazacyclooctane | [
"1,4-Diazepane",
"2,6-pyridinedicarboxylic acid",
"Trimethylglycine",
"1,5-diazacyclooctane"
] | [
2.4691,
1.8261,
1.0792,
2.5391
] | p-Sulfonatothiacalix[4]arene | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-Sulfonatothiacalix[4]arene in aqueous solution at standard conditions?
A. 1,4-Diazepane (SMILES: C1C... | eupmc | base |
t2_p-Sulfonatothiacalix[4]arene_16 | task2 | A | 4-methylpyridine | [
"4-methylpyridine",
"Pyridine",
"2,6-Dichloropyridine",
"Trimethylglycine"
] | [
2.4638,
2.1959,
2.3655,
1.0792
] | p-Sulfonatothiacalix[4]arene | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-Sulfonatothiacalix[4]arene in aqueous solution at standard conditions?
A. 4-methylpyridine (SMILES: ... | eupmc | base |
t2_p-Sulfonatothiacalix[4]arene_17 | task2 | D | Benzyltrimethylammonium chloride | [
"2,6-pyridinedicarboxylic acid",
"Acetylcholine",
"2-methylpyridine",
"Benzyltrimethylammonium chloride"
] | [
1.8261,
2.73,
2.6916,
3.27
] | p-Sulfonatothiacalix[4]arene | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-Sulfonatothiacalix[4]arene in aqueous solution at standard conditions?
A. 2,6-pyridinedicarboxylic a... | eupmc | base |
t2_p-sulfonatocalix[4]arene-(bromo-substituted)_0 | task2 | C | Lucigenin | [
"Ac-AARKSAPY-NH2",
"N6-Trimethyllysine",
"Lucigenin",
"L-Lysine"
] | [
4.8762,
3.5911,
7.0792,
2.6435
] | p-sulfonatocalix[4]arene-(bromo-substituted) | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-sulfonatocalix[4]arene-(bromo-substituted) in aqueous solution at standard conditions?
A. Ac-AARKSAP... | eupmc | base |
t2_p-sulfonatocalix[4]arene-(bromo-substituted)_1 | task2 | A | Ac-AARKme3SAPY-NH2 | [
"Ac-AARKme3SAPY-NH2",
"L-Lysine",
"N6-Trimethyllysine",
"Ac-AARKSAPY-NH2"
] | [
6.1553,
2.6435,
3.5911,
4.8762
] | p-sulfonatocalix[4]arene-(bromo-substituted) | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-sulfonatocalix[4]arene-(bromo-substituted) in aqueous solution at standard conditions?
A. Ac-AARKme3... | eupmc | base |
t2_p-sulfonatocalix[4]arene-(bromo-substituted)_2 | task2 | A | Lucigenin | [
"Lucigenin",
"Ac-AARKme3SAPY-NH2",
"N6-Trimethyllysine",
"Ac-AARKSAPY-NH2"
] | [
7.0792,
6.1553,
3.5911,
4.8762
] | p-sulfonatocalix[4]arene-(bromo-substituted) | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-sulfonatocalix[4]arene-(bromo-substituted) in aqueous solution at standard conditions?
A. Lucigenin ... | eupmc | base |
t2_p-sulfonatocalix[4]arene-(bromo-substituted)_3 | task2 | B | Lucigenin | [
"Ac-AARKme3SAPY-NH2",
"Lucigenin",
"Ac-AARKSAPY-NH2",
"L-Lysine"
] | [
6.1553,
7.0792,
4.8762,
2.6435
] | p-sulfonatocalix[4]arene-(bromo-substituted) | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-sulfonatocalix[4]arene-(bromo-substituted) in aqueous solution at standard conditions?
A. Ac-AARKme3... | eupmc | base |
t2_p-sulfonatocalix[4]arene-(bromo-substituted)_4 | task2 | C | Lucigenin | [
"L-Lysine",
"N6-Trimethyllysine",
"Lucigenin",
"Ac-AARKme3SAPY-NH2"
] | [
2.6435,
3.5911,
7.0792,
6.1553
] | p-sulfonatocalix[4]arene-(bromo-substituted) | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-sulfonatocalix[4]arene-(bromo-substituted) in aqueous solution at standard conditions?
A. L-Lysine (... | eupmc | base |
t2_p-sulfonatocalix[4]arene-(carboxamidophenyl-substituted)_0 | task2 | A | Lucigenin | [
"Lucigenin",
"Ac-AARKSAPY-NH2",
"Ac-AARKme3SAPY-NH2",
"L-Lysine"
] | [
6.9063,
4.6335,
5.7308,
2.1461
] | p-sulfonatocalix[4]arene-(carboxamidophenyl-substituted) | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-sulfonatocalix[4]arene-(carboxamidophenyl-substituted) in aqueous solution at standard conditions?
A... | eupmc | base |
t2_p-sulfonatocalix[4]arene-(carboxamidophenyl-substituted)_1 | task2 | A | Ac-AARKme3SAPY-NH2 | [
"Ac-AARKme3SAPY-NH2",
"Ac-AARKSAPY-NH2",
"L-Lysine",
"N6-Trimethyllysine"
] | [
5.7308,
4.6335,
2.1461,
3.7709
] | p-sulfonatocalix[4]arene-(carboxamidophenyl-substituted) | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-sulfonatocalix[4]arene-(carboxamidophenyl-substituted) in aqueous solution at standard conditions?
A... | eupmc | base |
t2_p-sulfonatocalix[4]arene-(carboxamidophenyl-substituted)_2 | task2 | C | Lucigenin | [
"N6-Trimethyllysine",
"L-Lysine",
"Lucigenin",
"Ac-AARKSAPY-NH2"
] | [
3.7709,
2.1461,
6.9063,
4.6335
] | p-sulfonatocalix[4]arene-(carboxamidophenyl-substituted) | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-sulfonatocalix[4]arene-(carboxamidophenyl-substituted) in aqueous solution at standard conditions?
A... | eupmc | base |
t2_p-sulfonatocalix[4]arene-(carboxamidophenyl-substituted)_3 | task2 | C | Lucigenin | [
"N6-Trimethyllysine",
"Ac-AARKme3SAPY-NH2",
"Lucigenin",
"L-Lysine"
] | [
3.7709,
5.7308,
6.9063,
2.1461
] | p-sulfonatocalix[4]arene-(carboxamidophenyl-substituted) | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-sulfonatocalix[4]arene-(carboxamidophenyl-substituted) in aqueous solution at standard conditions?
A... | eupmc | base |
t2_p-sulfonatocalix[4]arene-(carboxamidophenyl-substituted)_4 | task2 | D | Lucigenin | [
"Ac-AARKme3SAPY-NH2",
"Ac-AARKSAPY-NH2",
"N6-Trimethyllysine",
"Lucigenin"
] | [
5.7308,
4.6335,
3.7709,
6.9063
] | p-sulfonatocalix[4]arene-(carboxamidophenyl-substituted) | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-sulfonatocalix[4]arene-(carboxamidophenyl-substituted) in aqueous solution at standard conditions?
A... | eupmc | base |
t2_p-sulfonatocalix[4]arene-(carboxysulfonamide-substituted)_0 | task2 | D | H-ARTK(me3)QTARKSTGY-NH2 | [
"L-Lysine",
"N6-Trimethyllysine",
"H-ARTKQTARK(me3)STGY-NH2",
"H-ARTK(me3)QTARKSTGY-NH2"
] | [
2.0792,
3.4624,
6.7243,
7.7903
] | p-sulfonatocalix[4]arene-(carboxysulfonamide-substituted) | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-sulfonatocalix[4]arene-(carboxysulfonamide-substituted) in aqueous solution at standard conditions?
... | eupmc | base |
t2_p-sulfonatocalix[4]arene-(cyanophenyl-substituted_0 | task2 | C | Lucigenin | [
"Ac-AARKme3SAPY-NH2",
"L-Lysine",
"Lucigenin",
"Ac-AARKSAPY-NH2"
] | [
6.0569,
2.3222,
7.301,
4.9469
] | p-sulfonatocalix[4]arene-(cyanophenyl-substituted | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-sulfonatocalix[4]arene-(cyanophenyl-substituted in aqueous solution at standard conditions?
A. Ac-AA... | eupmc | base |
t2_p-sulfonatocalix[4]arene-(cyanophenyl-substituted_1 | task2 | C | Lucigenin | [
"N6-Trimethyllysine",
"Ac-AARKSAPY-NH2",
"Lucigenin",
"L-Lysine"
] | [
3.3222,
4.9469,
7.301,
2.3222
] | p-sulfonatocalix[4]arene-(cyanophenyl-substituted | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-sulfonatocalix[4]arene-(cyanophenyl-substituted in aqueous solution at standard conditions?
A. N6-Tr... | eupmc | base |
t2_p-sulfonatocalix[4]arene-(cyanophenyl-substituted_2 | task2 | A | Ac-AARKme3SAPY-NH2 | [
"Ac-AARKme3SAPY-NH2",
"N6-Trimethyllysine",
"L-Lysine",
"Ac-AARKSAPY-NH2"
] | [
6.0569,
3.3222,
2.3222,
4.9469
] | p-sulfonatocalix[4]arene-(cyanophenyl-substituted | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-sulfonatocalix[4]arene-(cyanophenyl-substituted in aqueous solution at standard conditions?
A. Ac-AA... | eupmc | base |
t2_p-sulfonatocalix[4]arene-(cyanophenyl-substituted_3 | task2 | A | Lucigenin | [
"Lucigenin",
"Ac-AARKme3SAPY-NH2",
"L-Lysine",
"N6-Trimethyllysine"
] | [
7.301,
6.0569,
2.3222,
3.3222
] | p-sulfonatocalix[4]arene-(cyanophenyl-substituted | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-sulfonatocalix[4]arene-(cyanophenyl-substituted in aqueous solution at standard conditions?
A. Lucig... | eupmc | base |
t2_p-sulfonatocalix[4]arene-(cyanophenyl-substituted_4 | task2 | B | Lucigenin | [
"Ac-AARKme3SAPY-NH2",
"Lucigenin",
"N6-Trimethyllysine",
"Ac-AARKSAPY-NH2"
] | [
6.0569,
7.301,
3.3222,
4.9469
] | p-sulfonatocalix[4]arene-(cyanophenyl-substituted | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-sulfonatocalix[4]arene-(cyanophenyl-substituted in aqueous solution at standard conditions?
A. Ac-AA... | eupmc | base |
t2_p-sulfonatocalix[4]arene-(mono amidomethyl-substituted)_0 | task2 | A | D/L-Arginine | [
"D/L-Arginine",
"D/L-histidine",
"D/L-Proline",
"Glycine"
] | [
2.9243,
2.3181,
2.5647,
1.4771
] | p-sulfonatocalix[4]arene-(mono amidomethyl-substituted) | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-sulfonatocalix[4]arene-(mono amidomethyl-substituted) in aqueous solution at standard conditions?
A.... | eupmc | base |
t2_p-sulfonatocalix[4]arene-(mono amidomethyl-substituted)_1 | task2 | C | D/L-lysine | [
"D/L-Alanine",
"D/L-Leucine",
"D/L-lysine",
"D/L-phenylalanine"
] | [
2.0086,
2.4378,
2.7619,
2.6928
] | p-sulfonatocalix[4]arene-(mono amidomethyl-substituted) | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-sulfonatocalix[4]arene-(mono amidomethyl-substituted) in aqueous solution at standard conditions?
A.... | eupmc | base |
t2_p-sulfonatocalix[4]arene-(mono amidomethyl-substituted)_2 | task2 | C | D/L-Aspartic acid | [
"D/L-Serine",
"Glycine",
"D/L-Aspartic acid",
"D/L-phenylalanine"
] | [
2.7324,
1.4771,
3.3522,
2.6928
] | p-sulfonatocalix[4]arene-(mono amidomethyl-substituted) | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-sulfonatocalix[4]arene-(mono amidomethyl-substituted) in aqueous solution at standard conditions?
A.... | eupmc | base |
t2_p-sulfonatocalix[4]arene-(mono amidomethyl-substituted)_3 | task2 | B | D/L-Aspartic acid | [
"D/L-histidine",
"D/L-Aspartic acid",
"D/L-Serine",
"D/L-lysine"
] | [
2.3181,
3.3522,
2.7324,
2.7619
] | p-sulfonatocalix[4]arene-(mono amidomethyl-substituted) | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-sulfonatocalix[4]arene-(mono amidomethyl-substituted) in aqueous solution at standard conditions?
A.... | eupmc | base |
t2_p-sulfonatocalix[4]arene-(mono amidomethyl-substituted)_4 | task2 | A | D/L-Aspartic acid | [
"D/L-Aspartic acid",
"D/L-histidine",
"D/L-Alanine",
"D/L-phenylalanine"
] | [
3.3522,
2.3181,
2.0086,
2.6928
] | p-sulfonatocalix[4]arene-(mono amidomethyl-substituted) | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-sulfonatocalix[4]arene-(mono amidomethyl-substituted) in aqueous solution at standard conditions?
A.... | eupmc | base |
t2_p-sulfonatocalix[4]arene-(mono amidomethyl-substituted)_5 | task2 | D | D/L-Aspartic acid | [
"D/L-Proline",
"D/L-Serine",
"D/L-Tryptophan",
"D/L-Aspartic acid"
] | [
2.5647,
2.7324,
2.3243,
3.3522
] | p-sulfonatocalix[4]arene-(mono amidomethyl-substituted) | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-sulfonatocalix[4]arene-(mono amidomethyl-substituted) in aqueous solution at standard conditions?
A.... | eupmc | base |
t2_p-sulfonatocalix[4]arene-(mono amidomethyl-substituted)_6 | task2 | B | D/L-Aspartic acid | [
"D/L-Leucine",
"D/L-Aspartic acid",
"D/L-Tryptophan",
"Glycine"
] | [
2.4378,
3.3522,
2.3243,
1.4771
] | p-sulfonatocalix[4]arene-(mono amidomethyl-substituted) | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-sulfonatocalix[4]arene-(mono amidomethyl-substituted) in aqueous solution at standard conditions?
A.... | eupmc | base |
t2_p-sulfonatocalix[4]arene-(mono amidomethyl-substituted)_7 | task2 | C | D/L-phenylalanine | [
"D/L-Alanine",
"D/L-Leucine",
"D/L-phenylalanine",
"D/L-Tryptophan"
] | [
2.0086,
2.4378,
2.6928,
2.3243
] | p-sulfonatocalix[4]arene-(mono amidomethyl-substituted) | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-sulfonatocalix[4]arene-(mono amidomethyl-substituted) in aqueous solution at standard conditions?
A.... | eupmc | base |
t2_p-sulfonatocalix[4]arene-(mono amidomethyl-substituted)_8 | task2 | A | D/L-Arginine | [
"D/L-Arginine",
"D/L-Leucine",
"D/L-Tryptophan",
"D/L-lysine"
] | [
2.9243,
2.4378,
2.3243,
2.7619
] | p-sulfonatocalix[4]arene-(mono amidomethyl-substituted) | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-sulfonatocalix[4]arene-(mono amidomethyl-substituted) in aqueous solution at standard conditions?
A.... | eupmc | base |
t2_p-sulfonatocalix[4]arene-(mono amidomethyl-substituted)_9 | task2 | B | D/L-lysine | [
"D/L-Leucine",
"D/L-lysine",
"Glycine",
"D/L-Serine"
] | [
2.4378,
2.7619,
1.4771,
2.7324
] | p-sulfonatocalix[4]arene-(mono amidomethyl-substituted) | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-sulfonatocalix[4]arene-(mono amidomethyl-substituted) in aqueous solution at standard conditions?
A.... | eupmc | base |
t2_p-sulfonatocalix[4]arene-(mono amidomethyl-substituted)_10 | task2 | C | D/L-Arginine | [
"D/L-Leucine",
"D/L-histidine",
"D/L-Arginine",
"D/L-phenylalanine"
] | [
2.4378,
2.3181,
2.9243,
2.6928
] | p-sulfonatocalix[4]arene-(mono amidomethyl-substituted) | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-sulfonatocalix[4]arene-(mono amidomethyl-substituted) in aqueous solution at standard conditions?
A.... | eupmc | base |
t2_p-sulfonatocalix[4]arene-(mono aminoethyl-substituted)_0 | task2 | D | D/L-Arginine | [
"D/L-Alanine",
"D/L-phenylalanine",
"D/L-Leucine",
"D/L-Arginine"
] | [
1.9956,
2.4533,
2.4886,
2.6503
] | p-sulfonatocalix[4]arene-(mono aminoethyl-substituted) | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-sulfonatocalix[4]arene-(mono aminoethyl-substituted) in aqueous solution at standard conditions?
A. ... | eupmc | base |
t2_p-sulfonatocalix[4]arene-(mono aminoethyl-substituted)_1 | task2 | A | D/L-Aspartic acid | [
"D/L-Aspartic acid",
"D/L-phenylalanine",
"D/L-Alanine",
"D/L-Arginine"
] | [
3.7497,
2.4533,
1.9956,
2.6503
] | p-sulfonatocalix[4]arene-(mono aminoethyl-substituted) | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-sulfonatocalix[4]arene-(mono aminoethyl-substituted) in aqueous solution at standard conditions?
A. ... | eupmc | base |
t2_p-sulfonatocalix[4]arene-(mono aminoethyl-substituted)_2 | task2 | D | D/L-Aspartic acid | [
"D/L-Arginine",
"D/L-histidine",
"Glycine",
"D/L-Aspartic acid"
] | [
2.6503,
2.3139,
1.6335,
3.7497
] | p-sulfonatocalix[4]arene-(mono aminoethyl-substituted) | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-sulfonatocalix[4]arene-(mono aminoethyl-substituted) in aqueous solution at standard conditions?
A. ... | eupmc | base |
t2_p-sulfonatocalix[4]arene-(mono aminoethyl-substituted)_3 | task2 | B | D/L-phenylalanine | [
"Glycine",
"D/L-phenylalanine",
"D/L-lysine",
"D/L-histidine"
] | [
1.6335,
2.4533,
2.3054,
2.3139
] | p-sulfonatocalix[4]arene-(mono aminoethyl-substituted) | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-sulfonatocalix[4]arene-(mono aminoethyl-substituted) in aqueous solution at standard conditions?
A. ... | eupmc | base |
t2_p-sulfonatocalix[4]arene-(mono aminoethyl-substituted)_4 | task2 | A | D/L-Aspartic acid | [
"D/L-Aspartic acid",
"D/L-Leucine",
"D/L-Arginine",
"Glycine"
] | [
3.7497,
2.4886,
2.6503,
1.6335
] | p-sulfonatocalix[4]arene-(mono aminoethyl-substituted) | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-sulfonatocalix[4]arene-(mono aminoethyl-substituted) in aqueous solution at standard conditions?
A. ... | eupmc | base |
t2_p-sulfonatocalix[4]arene-(mono aminoethyl-substituted)_5 | task2 | A | D/L-Arginine | [
"D/L-Arginine",
"Glycine",
"D/L-Leucine",
"D/L-Proline"
] | [
2.6503,
1.6335,
2.4886,
2.3181
] | p-sulfonatocalix[4]arene-(mono aminoethyl-substituted) | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-sulfonatocalix[4]arene-(mono aminoethyl-substituted) in aqueous solution at standard conditions?
A. ... | eupmc | base |
t2_p-sulfonatocalix[4]arene-(mono aminoethyl-substituted)_6 | task2 | A | D/L-Arginine | [
"D/L-Arginine",
"Glycine",
"D/L-histidine",
"D/L-lysine"
] | [
2.6503,
1.6335,
2.3139,
2.3054
] | p-sulfonatocalix[4]arene-(mono aminoethyl-substituted) | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-sulfonatocalix[4]arene-(mono aminoethyl-substituted) in aqueous solution at standard conditions?
A. ... | eupmc | base |
t2_p-sulfonatocalix[4]arene-(mono aminoethyl-substituted)_7 | task2 | C | D/L-Aspartic acid | [
"D/L-Leucine",
"D/L-phenylalanine",
"D/L-Aspartic acid",
"D/L-Serine"
] | [
2.4886,
2.4533,
3.7497,
2.6232
] | p-sulfonatocalix[4]arene-(mono aminoethyl-substituted) | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-sulfonatocalix[4]arene-(mono aminoethyl-substituted) in aqueous solution at standard conditions?
A. ... | eupmc | base |
t2_p-sulfonatocalix[4]arene-(mono aminoethyl-substituted)_8 | task2 | C | D/L-Arginine | [
"D/L-phenylalanine",
"D/L-Serine",
"D/L-Arginine",
"Glycine"
] | [
2.4533,
2.6232,
2.6503,
1.6335
] | p-sulfonatocalix[4]arene-(mono aminoethyl-substituted) | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-sulfonatocalix[4]arene-(mono aminoethyl-substituted) in aqueous solution at standard conditions?
A. ... | eupmc | base |
t2_p-sulfonatocalix[4]arene-(mono aminoethyl-substituted)_9 | task2 | B | D/L-Aspartic acid | [
"Glycine",
"D/L-Aspartic acid",
"D/L-Tryptophan",
"D/L-Alanine"
] | [
1.6335,
3.7497,
2.3118,
1.9956
] | p-sulfonatocalix[4]arene-(mono aminoethyl-substituted) | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-sulfonatocalix[4]arene-(mono aminoethyl-substituted) in aqueous solution at standard conditions?
A. ... | eupmc | base |
t2_p-sulfonatocalix[4]arene-(mono aminoethyl-substituted)_10 | task2 | D | D/L-Arginine | [
"D/L-Leucine",
"D/L-Tryptophan",
"D/L-Alanine",
"D/L-Arginine"
] | [
2.4886,
2.3118,
1.9956,
2.6503
] | p-sulfonatocalix[4]arene-(mono aminoethyl-substituted) | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-sulfonatocalix[4]arene-(mono aminoethyl-substituted) in aqueous solution at standard conditions?
A. ... | eupmc | base |
t2_p-sulfonatocalix[4]arene-(mono-carboxymethyl-substituted)_0 | task2 | C | D/L-Serine | [
"D/L-lysine",
"Glycine",
"D/L-Serine",
"D/L-Arginine"
] | [
2.9479,
1.716,
3.5508,
2.9031
] | p-sulfonatocalix[4]arene-(mono-carboxymethyl-substituted) | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-sulfonatocalix[4]arene-(mono-carboxymethyl-substituted) in aqueous solution at standard conditions?
... | eupmc | base |
t2_p-sulfonatocalix[4]arene-(mono-carboxymethyl-substituted)_1 | task2 | D | D/L-lysine | [
"D/L-Leucine",
"D/L-histidine",
"D/L-Tryptophan",
"D/L-lysine"
] | [
2.6884,
2.4857,
2.2504,
2.9479
] | p-sulfonatocalix[4]arene-(mono-carboxymethyl-substituted) | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-sulfonatocalix[4]arene-(mono-carboxymethyl-substituted) in aqueous solution at standard conditions?
... | eupmc | base |
t2_p-sulfonatocalix[4]arene-(mono-carboxymethyl-substituted)_2 | task2 | C | D/L-Aspartic acid | [
"Glycine",
"D/L-Arginine",
"D/L-Aspartic acid",
"D/L-phenylalanine"
] | [
1.716,
2.9031,
3.4551,
2.5933
] | p-sulfonatocalix[4]arene-(mono-carboxymethyl-substituted) | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-sulfonatocalix[4]arene-(mono-carboxymethyl-substituted) in aqueous solution at standard conditions?
... | eupmc | base |
t2_p-sulfonatocalix[4]arene-(mono-carboxymethyl-substituted)_3 | task2 | B | D/L-Serine | [
"D/L-Leucine",
"D/L-Serine",
"D/L-Tryptophan",
"D/L-Arginine"
] | [
2.6884,
3.5508,
2.2504,
2.9031
] | p-sulfonatocalix[4]arene-(mono-carboxymethyl-substituted) | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-sulfonatocalix[4]arene-(mono-carboxymethyl-substituted) in aqueous solution at standard conditions?
... | eupmc | base |
t2_p-sulfonatocalix[4]arene-(mono-carboxymethyl-substituted)_4 | task2 | D | D/L-Serine | [
"D/L-histidine",
"D/L-Arginine",
"D/L-Leucine",
"D/L-Serine"
] | [
2.4857,
2.9031,
2.6884,
3.5508
] | p-sulfonatocalix[4]arene-(mono-carboxymethyl-substituted) | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-sulfonatocalix[4]arene-(mono-carboxymethyl-substituted) in aqueous solution at standard conditions?
... | eupmc | base |
t2_p-sulfonatocalix[4]arene-(mono-carboxymethyl-substituted)_5 | task2 | A | D/L-Serine | [
"D/L-Serine",
"D/L-Tryptophan",
"D/L-histidine",
"D/L-Proline"
] | [
3.5508,
2.2504,
2.4857,
2.6803
] | p-sulfonatocalix[4]arene-(mono-carboxymethyl-substituted) | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-sulfonatocalix[4]arene-(mono-carboxymethyl-substituted) in aqueous solution at standard conditions?
... | eupmc | base |
t2_p-sulfonatocalix[4]arene-(mono-carboxymethyl-substituted)_6 | task2 | D | D/L-Serine | [
"Glycine",
"D/L-Aspartic acid",
"D/L-phenylalanine",
"D/L-Serine"
] | [
1.716,
3.4551,
2.5933,
3.5508
] | p-sulfonatocalix[4]arene-(mono-carboxymethyl-substituted) | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-sulfonatocalix[4]arene-(mono-carboxymethyl-substituted) in aqueous solution at standard conditions?
... | eupmc | base |
t2_p-sulfonatocalix[4]arene-(mono-carboxymethyl-substituted)_7 | task2 | D | D/L-lysine | [
"D/L-Arginine",
"Glycine",
"D/L-Alanine",
"D/L-lysine"
] | [
2.9031,
1.716,
1.9191,
2.9479
] | p-sulfonatocalix[4]arene-(mono-carboxymethyl-substituted) | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-sulfonatocalix[4]arene-(mono-carboxymethyl-substituted) in aqueous solution at standard conditions?
... | eupmc | base |
t2_p-sulfonatocalix[4]arene-(mono-carboxymethyl-substituted)_8 | task2 | A | D/L-Aspartic acid | [
"D/L-Aspartic acid",
"D/L-Arginine",
"D/L-Alanine",
"D/L-Tryptophan"
] | [
3.4551,
2.9031,
1.9191,
2.2504
] | p-sulfonatocalix[4]arene-(mono-carboxymethyl-substituted) | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-sulfonatocalix[4]arene-(mono-carboxymethyl-substituted) in aqueous solution at standard conditions?
... | eupmc | base |
t2_p-sulfonatocalix[4]arene-(mono-carboxymethyl-substituted)_9 | task2 | C | D/L-Serine | [
"D/L-phenylalanine",
"D/L-Leucine",
"D/L-Serine",
"D/L-Arginine"
] | [
2.5933,
2.6884,
3.5508,
2.9031
] | p-sulfonatocalix[4]arene-(mono-carboxymethyl-substituted) | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-sulfonatocalix[4]arene-(mono-carboxymethyl-substituted) in aqueous solution at standard conditions?
... | eupmc | base |
t2_p-sulfonatocalix[4]arene-(mono-carboxymethyl-substituted)_10 | task2 | A | D/L-Serine | [
"D/L-Serine",
"D/L-Alanine",
"Glycine",
"D/L-Tryptophan"
] | [
3.5508,
1.9191,
1.716,
2.2504
] | p-sulfonatocalix[4]arene-(mono-carboxymethyl-substituted) | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-sulfonatocalix[4]arene-(mono-carboxymethyl-substituted) in aqueous solution at standard conditions?
... | eupmc | base |
t2_p-sulfonatocalix[4]arene-(nitro-substituted)_0 | task2 | C | Lucigenin | [
"L-Lysine",
"Ac-AARKme3SAPY-NH2",
"Lucigenin",
"N6-Trimethyllysine"
] | [
2.1761,
5,
6.3365,
3.2304
] | p-sulfonatocalix[4]arene-(nitro-substituted) | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-sulfonatocalix[4]arene-(nitro-substituted) in aqueous solution at standard conditions?
A. L-Lysine (... | eupmc | base |
t2_p-sulfonatocalix[4]arene-(phenyl)_0 | task2 | B | Lucigenin | [
"Ac-AARKme3SAPY-NH2",
"Lucigenin",
"N6-Trimethyllysine",
"L-Lysine"
] | [
6.1239,
7.2601,
4.8062,
2.6232
] | p-sulfonatocalix[4]arene-(phenyl) | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-sulfonatocalix[4]arene-(phenyl) in aqueous solution at standard conditions?
A. Ac-AARKme3SAPY-NH2 (S... | eupmc | base |
t2_p-sulfonatocalix[4]arene-(phenyl)_1 | task2 | B | Ac-AARKme3SAPY-NH2 | [
"N6-Trimethyllysine",
"Ac-AARKme3SAPY-NH2",
"L-Lysine",
"Ac-AARKSAPY-NH2"
] | [
4.8062,
6.1239,
2.6232,
4.721
] | p-sulfonatocalix[4]arene-(phenyl) | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-sulfonatocalix[4]arene-(phenyl) in aqueous solution at standard conditions?
A. N6-Trimethyllysine (S... | eupmc | base |
t2_p-sulfonatocalix[4]arene-(phenyl)_2 | task2 | B | Lucigenin | [
"Ac-AARKSAPY-NH2",
"Lucigenin",
"L-Lysine",
"N6-Trimethyllysine"
] | [
4.721,
7.2601,
2.6232,
4.8062
] | p-sulfonatocalix[4]arene-(phenyl) | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-sulfonatocalix[4]arene-(phenyl) in aqueous solution at standard conditions?
A. Ac-AARKSAPY-NH2 (SMIL... | eupmc | base |
t2_p-sulfonatocalix[4]arene-(phenyl)_3 | task2 | D | Lucigenin | [
"Ac-AARKSAPY-NH2",
"N6-Trimethyllysine",
"Ac-AARKme3SAPY-NH2",
"Lucigenin"
] | [
4.721,
4.8062,
6.1239,
7.2601
] | p-sulfonatocalix[4]arene-(phenyl) | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-sulfonatocalix[4]arene-(phenyl) in aqueous solution at standard conditions?
A. Ac-AARKSAPY-NH2 (SMIL... | eupmc | base |
t2_p-sulfonatocalix[4]arene-(phenyl)_4 | task2 | A | Lucigenin | [
"Lucigenin",
"L-Lysine",
"Ac-AARKSAPY-NH2",
"Ac-AARKme3SAPY-NH2"
] | [
7.2601,
2.6232,
4.721,
6.1239
] | p-sulfonatocalix[4]arene-(phenyl) | v2 | You are an expert in supramolecular chemistry.
Your task is to answer the following question.
Question: Which of the following guest molecules has the strongest binding affinity (highest logKa) with the host molecule p-sulfonatocalix[4]arene-(phenyl) in aqueous solution at standard conditions?
A. Lucigenin (SMILES: C[... | eupmc | base |
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