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t2_Corral[5]arene_3
task2
C
(S)-1,1,2,4,4-pentamethylpiperazine-1,4-diium
[ "(1s,3s,5s,7s)-N1,N1,N1,N3,N3,N3-hexamethyladamantane-1,3-diaminium", "4,4'-(ethane-1,2-diyl)bis(1-(tert-butyl)pyridin-1-ium)", "(S)-1,1,2,4,4-pentamethylpiperazine-1,4-diium", "4,4'-(1,4-phenylene)bis(1-hexylpyridin-1-ium)" ]
[ 5.2625, 5.9628, 6.9217, 4.5635 ]
Corral[5]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 Corral[5]arene in aqueous solution at standard conditions? A. (1s,3s,5s,7s)-N1,N1,N1,N3,N3,N3-hexameth...
eupmc
base
t2_Corral[5]arene_4
task2
A
4,4'-(ethane-1,2-diyl)bis(1-(tert-butyl)pyridin-1-ium)
[ "4,4'-(ethane-1,2-diyl)bis(1-(tert-butyl)pyridin-1-ium)", "(1s,3s,5s,7s)-N1,N1,N1,N3,N3,N3-hexamethyladamantane-1,3-diaminium", "4,4'-(1,4-phenylene)bis(1-hexylpyridin-1-ium)", "3-carboxy-1-methylpyridin-1-ium" ]
[ 5.9628, 5.2625, 4.5635, 3.6425 ]
Corral[5]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 Corral[5]arene in aqueous solution at standard conditions? A. 4,4'-(ethane-1,2-diyl)bis(1-(tert-butyl)...
eupmc
base
t2_Corral[5]arene_5
task2
B
4,4'-(ethane-1,2-diyl)bis(1-(tert-butyl)pyridin-1-ium)
[ "(E)-4,4'-(ethene-1,2-diyl)bis(1-butylpyridin-1-ium)", "4,4'-(ethane-1,2-diyl)bis(1-(tert-butyl)pyridin-1-ium)", "3-carboxy-1-methylpyridin-1-ium", "1,1'-dibutyl-[4,4'-bipyridine]-1,1'-diium" ]
[ 4.6232, 5.9628, 3.6425, 4.9974 ]
Corral[5]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 Corral[5]arene in aqueous solution at standard conditions? A. (E)-4,4'-(ethene-1,2-diyl)bis(1-butylpyr...
eupmc
base
t2_Corral[5]arene_6
task2
A
(R)-1,1,2,4,4-pentamethylpiperazine-1,4-diium
[ "(R)-1,1,2,4,4-pentamethylpiperazine-1,4-diium", "1,1'-(propane-1,3-diyl)bis(4-(tert-butyl)pyridin-1-ium)", "(S)-1,1,2,4,4-pentamethylpiperazine-1,4-diium", "(E)-4,4'-(ethene-1,2-diyl)bis(1-butylpyridin-1-ium)" ]
[ 6.9899, 3.9289, 6.9217, 4.6232 ]
Corral[5]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 Corral[5]arene in aqueous solution at standard conditions? A. (R)-1,1,2,4,4-pentamethylpiperazine-1,4-...
eupmc
base
t2_Corral[5]arene_7
task2
B
(R)-1,1,2,4,4-pentamethylpiperazine-1,4-diium
[ "4,4'-(1,4-phenylene)bis(1-hexylpyridin-1-ium)", "(R)-1,1,2,4,4-pentamethylpiperazine-1,4-diium", "(S)-1,1,2,4,4-pentamethylpiperazine-1,4-diium", "4,4'-(ethane-1,2-diyl)bis(1-(tert-butyl)pyridin-1-ium)" ]
[ 4.5635, 6.9899, 6.9217, 5.9628 ]
Corral[5]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 Corral[5]arene in aqueous solution at standard conditions? A. 4,4'-(1,4-phenylene)bis(1-hexylpyridin-1...
eupmc
base
t2_Corral[5]arene_8
task2
C
(R)-1,1,2,4,4-pentamethylpiperazine-1,4-diium
[ "(E)-4,4'-(ethene-1,2-diyl)bis(1-butylpyridin-1-ium)", "(S)-1,1,2,4,4-pentamethylpiperazine-1,4-diium", "(R)-1,1,2,4,4-pentamethylpiperazine-1,4-diium", "3-carboxy-1-methylpyridin-1-ium" ]
[ 4.6232, 6.9217, 6.9899, 3.6425 ]
Corral[5]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 Corral[5]arene in aqueous solution at standard conditions? A. (E)-4,4'-(ethene-1,2-diyl)bis(1-butylpyr...
eupmc
base
t2_Cucurbit[5]uril_0
task2
B
Potassium nitrate
[ "Coptisine", "Potassium nitrate", "helium", "Ammonium nitrate" ]
[ 4.1584, 4.73, 1.9395, 2.4043 ]
Cucurbit[5]uril
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 Cucurbit[5]uril (SMILES: C1N2C3C4N(C2=O)CN5C6C7N(C5=O)CN8C9C2N(C8=O)CN5C8C%10N(C5=O)CN5C%11C(N1C5=O)N1C...
eupmc
base
t2_Cucurbit[5]uril_1
task2
B
Coptisine
[ "krypton", "Coptisine", "Ammonium nitrate", "Nitric acid" ]
[ 3.3784, 4.1584, 2.4043, 0.4997 ]
Cucurbit[5]uril
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 Cucurbit[5]uril (SMILES: C1N2C3C4N(C2=O)CN5C6C7N(C5=O)CN8C9C2N(C8=O)CN5C8C%10N(C5=O)CN5C%11C(N1C5=O)N1C...
eupmc
base
t2_Cucurbit[5]uril_2
task2
B
Potassium nitrate
[ "Rubidium nitrate", "Potassium nitrate", "Iron(III) nitrate nonahydrate", "Ethene" ]
[ 3.0371, 4.73, 3.4743, 2.3139 ]
Cucurbit[5]uril
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 Cucurbit[5]uril (SMILES: C1N2C3C4N(C2=O)CN5C6C7N(C5=O)CN8C9C2N(C8=O)CN5C8C%10N(C5=O)CN5C%11C(N1C5=O)N1C...
eupmc
base
t2_Cucurbit[5]uril_3
task2
A
Lanthanum(III) nitrate hexahydrate
[ "Lanthanum(III) nitrate hexahydrate", "Rubidium nitrate", "helium", "Xenon" ]
[ 3.9847, 3.0371, 1.9395, 3.9395 ]
Cucurbit[5]uril
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 Cucurbit[5]uril (SMILES: C1N2C3C4N(C2=O)CN5C6C7N(C5=O)CN8C9C2N(C8=O)CN5C8C%10N(C5=O)CN5C%11C(N1C5=O)N1C...
eupmc
base
t2_Cucurbit[5]uril_4
task2
C
Iron(III) nitrate nonahydrate
[ "neon", "ethane", "Iron(III) nitrate nonahydrate", "Calcium nitrate" ]
[ 1.8573, 1.3856, 3.4743, 2.4544 ]
Cucurbit[5]uril
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 Cucurbit[5]uril (SMILES: C1N2C3C4N(C2=O)CN5C6C7N(C5=O)CN8C9C2N(C8=O)CN5C8C%10N(C5=O)CN5C%11C(N1C5=O)N1C...
eupmc
base
t2_Cucurbit[5]uril_5
task2
A
methane
[ "methane", "Nitric acid", "Ammonium nitrate", "Lithium nitrate" ]
[ 3.2068, 0.4997, 2.4043, 2.0212 ]
Cucurbit[5]uril
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 Cucurbit[5]uril (SMILES: C1N2C3C4N(C2=O)CN5C6C7N(C5=O)CN8C9C2N(C8=O)CN5C8C%10N(C5=O)CN5C%11C(N1C5=O)N1C...
eupmc
base
t2_Cucurbit[5]uril_6
task2
B
Xenon
[ "molecular nitrogen", "Xenon", "Ytterbium nitrate", "helium" ]
[ 2.6335, 3.9395, 3.71, 1.9395 ]
Cucurbit[5]uril
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 Cucurbit[5]uril (SMILES: C1N2C3C4N(C2=O)CN5C6C7N(C5=O)CN8C9C2N(C8=O)CN5C8C%10N(C5=O)CN5C%11C(N1C5=O)N1C...
eupmc
base
t2_Cucurbit[5]uril_7
task2
B
Potassium nitrate
[ "Lanthanum(III) nitrate hexahydrate", "Potassium nitrate", "Xenon", "Ethene" ]
[ 3.9847, 4.73, 3.9395, 2.3139 ]
Cucurbit[5]uril
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 Cucurbit[5]uril (SMILES: C1N2C3C4N(C2=O)CN5C6C7N(C5=O)CN8C9C2N(C8=O)CN5C8C%10N(C5=O)CN5C%11C(N1C5=O)N1C...
eupmc
base
t2_Cucurbit[5]uril_8
task2
A
Coptisine
[ "Coptisine", "Iron(III) nitrate nonahydrate", "krypton", "Lithium nitrate" ]
[ 4.1584, 3.4743, 3.3784, 2.0212 ]
Cucurbit[5]uril
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 Cucurbit[5]uril (SMILES: C1N2C3C4N(C2=O)CN5C6C7N(C5=O)CN8C9C2N(C8=O)CN5C8C%10N(C5=O)CN5C%11C(N1C5=O)N1C...
eupmc
base
t2_Cucurbit[5]uril_9
task2
C
krypton
[ "molecular nitrogen", "Nickel nitrate", "krypton", "Lithium nitrate" ]
[ 2.6335, 2.7324, 3.3784, 2.0212 ]
Cucurbit[5]uril
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 Cucurbit[5]uril (SMILES: C1N2C3C4N(C2=O)CN5C6C7N(C5=O)CN8C9C2N(C8=O)CN5C8C%10N(C5=O)CN5C%11C(N1C5=O)N1C...
eupmc
base
t2_Cucurbit[5]uril_10
task2
C
Sodium nitrate
[ "neon", "argon", "Sodium nitrate", "Cesium nitrate" ]
[ 1.8573, 2.5563, 3.936, 2.6064 ]
Cucurbit[5]uril
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 Cucurbit[5]uril (SMILES: C1N2C3C4N(C2=O)CN5C6C7N(C5=O)CN8C9C2N(C8=O)CN5C8C%10N(C5=O)CN5C%11C(N1C5=O)N1C...
eupmc
base
t2_Cucurbit[5]uril_11
task2
B
Potassium nitrate
[ "ethane", "Potassium nitrate", "Lanthanum(III) nitrate hexahydrate", "neon" ]
[ 1.3856, 4.73, 3.9847, 1.8573 ]
Cucurbit[5]uril
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 Cucurbit[5]uril (SMILES: C1N2C3C4N(C2=O)CN5C6C7N(C5=O)CN8C9C2N(C8=O)CN5C8C%10N(C5=O)CN5C%11C(N1C5=O)N1C...
eupmc
base
t2_Cucurbit[5]uril_12
task2
B
Sanguinarine
[ "Xenon", "Sanguinarine", "Calcium nitrate", "krypton" ]
[ 3.9395, 4.0828, 2.4544, 3.3784 ]
Cucurbit[5]uril
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 Cucurbit[5]uril (SMILES: C1N2C3C4N(C2=O)CN5C6C7N(C5=O)CN8C9C2N(C8=O)CN5C8C%10N(C5=O)CN5C%11C(N1C5=O)N1C...
eupmc
base
t2_Cucurbit[5]uril_13
task2
C
Lanthanum(III) nitrate hexahydrate
[ "helium", "argon", "Lanthanum(III) nitrate hexahydrate", "krypton" ]
[ 1.9395, 2.5563, 3.9847, 3.3784 ]
Cucurbit[5]uril
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 Cucurbit[5]uril (SMILES: C1N2C3C4N(C2=O)CN5C6C7N(C5=O)CN8C9C2N(C8=O)CN5C8C%10N(C5=O)CN5C%11C(N1C5=O)N1C...
eupmc
base
t2_Cucurbit[5]uril_14
task2
B
Xenon
[ "Nitric acid", "Xenon", "molecular nitrogen", "Nickel nitrate" ]
[ 0.4997, 3.9395, 2.6335, 2.7324 ]
Cucurbit[5]uril
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 Cucurbit[5]uril (SMILES: C1N2C3C4N(C2=O)CN5C6C7N(C5=O)CN8C9C2N(C8=O)CN5C8C%10N(C5=O)CN5C%11C(N1C5=O)N1C...
eupmc
base
t2_Cucurbit[5]uril_15
task2
C
Coptisine
[ "Magnesium nitrate", "Xenon", "Coptisine", "Lanthanum(III) nitrate hexahydrate" ]
[ 2.5, 3.9395, 4.1584, 3.9847 ]
Cucurbit[5]uril
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 Cucurbit[5]uril (SMILES: C1N2C3C4N(C2=O)CN5C6C7N(C5=O)CN8C9C2N(C8=O)CN5C8C%10N(C5=O)CN5C%11C(N1C5=O)N1C...
eupmc
base
t2_Cucurbit[5]uril_16
task2
D
Sanguinarine
[ "Cesium nitrate", "argon", "ethane", "Sanguinarine" ]
[ 2.6064, 2.5563, 1.3856, 4.0828 ]
Cucurbit[5]uril
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 Cucurbit[5]uril (SMILES: C1N2C3C4N(C2=O)CN5C6C7N(C5=O)CN8C9C2N(C8=O)CN5C8C%10N(C5=O)CN5C%11C(N1C5=O)N1C...
eupmc
base
t2_Cucurbit[5]uril_17
task2
C
Potassium nitrate
[ "Nickel nitrate", "Calcium nitrate", "Potassium nitrate", "Lithium nitrate" ]
[ 2.7324, 2.4544, 4.73, 2.0212 ]
Cucurbit[5]uril
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 Cucurbit[5]uril (SMILES: C1N2C3C4N(C2=O)CN5C6C7N(C5=O)CN8C9C2N(C8=O)CN5C8C%10N(C5=O)CN5C%11C(N1C5=O)N1C...
eupmc
base
t2_Cucurbit[5]uril_18
task2
C
Rubidium nitrate
[ "Magnesium nitrate", "Cesium nitrate", "Rubidium nitrate", "Ethene" ]
[ 2.5, 2.6064, 3.0371, 2.3139 ]
Cucurbit[5]uril
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 Cucurbit[5]uril (SMILES: C1N2C3C4N(C2=O)CN5C6C7N(C5=O)CN8C9C2N(C8=O)CN5C8C%10N(C5=O)CN5C%11C(N1C5=O)N1C...
eupmc
base
t2_Cucurbit[5]uril_19
task2
A
Coptisine
[ "Coptisine", "Rubidium nitrate", "molecular nitrogen", "Ytterbium nitrate" ]
[ 4.1584, 3.0371, 2.6335, 3.71 ]
Cucurbit[5]uril
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 Cucurbit[5]uril (SMILES: C1N2C3C4N(C2=O)CN5C6C7N(C5=O)CN8C9C2N(C8=O)CN5C8C%10N(C5=O)CN5C%11C(N1C5=O)N1C...
eupmc
base
t2_Cucurbit[5]uril_20
task2
C
Coptisine
[ "Lanthanum(III) nitrate hexahydrate", "molecular nitrogen", "Coptisine", "Ammonium nitrate" ]
[ 3.9847, 2.6335, 4.1584, 2.4043 ]
Cucurbit[5]uril
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 Cucurbit[5]uril (SMILES: C1N2C3C4N(C2=O)CN5C6C7N(C5=O)CN8C9C2N(C8=O)CN5C8C%10N(C5=O)CN5C%11C(N1C5=O)N1C...
eupmc
base
t2_Cucurbit[5]uril_21
task2
A
Iron(III) nitrate nonahydrate
[ "Iron(III) nitrate nonahydrate", "Rubidium nitrate", "argon", "Nitric acid" ]
[ 3.4743, 3.0371, 2.5563, 0.4997 ]
Cucurbit[5]uril
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 Cucurbit[5]uril (SMILES: C1N2C3C4N(C2=O)CN5C6C7N(C5=O)CN8C9C2N(C8=O)CN5C8C%10N(C5=O)CN5C%11C(N1C5=O)N1C...
eupmc
base
t2_Cucurbit[5]uril_22
task2
A
Strontium nitrate
[ "Strontium nitrate", "methane", "Lanthanum(III) nitrate hexahydrate", "ethane" ]
[ 4.9697, 3.2068, 3.9847, 1.3856 ]
Cucurbit[5]uril
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 Cucurbit[5]uril (SMILES: C1N2C3C4N(C2=O)CN5C6C7N(C5=O)CN8C9C2N(C8=O)CN5C8C%10N(C5=O)CN5C%11C(N1C5=O)N1C...
eupmc
base
t2_Cucurbit[5]uril_23
task2
D
Cesium nitrate
[ "Nitric acid", "ethane", "Calcium nitrate", "Cesium nitrate" ]
[ 0.4997, 1.3856, 2.4544, 2.6064 ]
Cucurbit[5]uril
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 Cucurbit[5]uril (SMILES: C1N2C3C4N(C2=O)CN5C6C7N(C5=O)CN8C9C2N(C8=O)CN5C8C%10N(C5=O)CN5C%11C(N1C5=O)N1C...
eupmc
base
t2_Cucurbit[5]uril_24
task2
C
Potassium nitrate
[ "Lithium nitrate", "Ethene", "Potassium nitrate", "Ammonium nitrate" ]
[ 2.0212, 2.3139, 4.73, 2.4043 ]
Cucurbit[5]uril
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 Cucurbit[5]uril (SMILES: C1N2C3C4N(C2=O)CN5C6C7N(C5=O)CN8C9C2N(C8=O)CN5C8C%10N(C5=O)CN5C%11C(N1C5=O)N1C...
eupmc
base
t2_Cucurbit[5]uril_25
task2
D
Strontium nitrate
[ "methane", "Ethene", "molecular nitrogen", "Strontium nitrate" ]
[ 3.2068, 2.3139, 2.6335, 4.9697 ]
Cucurbit[5]uril
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 Cucurbit[5]uril (SMILES: C1N2C3C4N(C2=O)CN5C6C7N(C5=O)CN8C9C2N(C8=O)CN5C8C%10N(C5=O)CN5C%11C(N1C5=O)N1C...
eupmc
base
t2_Cucurbit[6]uril_0
task2
B
Hexamethylenediamine
[ "Isobutane-d10", "Hexamethylenediamine", "Dimethyl-(4-methylphenyl)sulfanium", "Coptisine" ]
[ 5.959, 6.4201, 1, 4.1072 ]
Cucurbit[6]uril
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 Cucurbit[6]uril (SMILES: C1N2C3C4N(C2=O)CN5C6C7N(C5=O)CN8C9C2N(C8=O)CN5C8C%10N(C5=O)CN5C%11C%12N(C5=O)C...
eupmc
base
t2_Cucurbit[6]uril_1
task2
B
Rubidium chloride
[ "3-aminopropanoic acid", "Rubidium chloride", "L-Valine", "L-Phenylalanine" ]
[ 3.37, 4.301, 3.1501, 3.16 ]
Cucurbit[6]uril
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 Cucurbit[6]uril (SMILES: C1N2C3C4N(C2=O)CN5C6C7N(C5=O)CN8C9C2N(C8=O)CN5C8C%10N(C5=O)CN5C%11C%12N(C5=O)C...
eupmc
base
t2_Cucurbit[6]uril_2
task2
A
1-methyl-3-propylimidazol-1-ium;bromide
[ "1-methyl-3-propylimidazol-1-ium;bromide", "P-Xylylenediamine", "4-aminobutyric acid", "1-Pentanol" ]
[ 4, 2.7404, 3.4, 2.6726 ]
Cucurbit[6]uril
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 Cucurbit[6]uril (SMILES: C1N2C3C4N(C2=O)CN5C6C7N(C5=O)CN8C9C2N(C8=O)CN5C8C%10N(C5=O)CN5C%11C%12N(C5=O)C...
eupmc
base
t2_Cucurbit[6]uril_3
task2
C
thiophen-2-ylmethanaminium
[ "1-heptanoic acid", "Cyclohexanemethylamine", "thiophen-2-ylmethanaminium", "1-(2-carboxyethyl)-3,5-dimethyl-Pyridinium" ]
[ 2.7709, 2.2261, 5.5772, 4.4472 ]
Cucurbit[6]uril
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 Cucurbit[6]uril (SMILES: C1N2C3C4N(C2=O)CN5C6C7N(C5=O)CN8C9C2N(C8=O)CN5C8C%10N(C5=O)CN5C%11C%12N(C5=O)C...
eupmc
base
t2_Cucurbit[6]uril_4
task2
B
butylamine (protonated form)
[ "5-aminovaleric acid", "butylamine (protonated form)", "Sodium cation", "Nonanoic acid" ]
[ 3.5899, 5, 3.2466, 2.7924 ]
Cucurbit[6]uril
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 Cucurbit[6]uril (SMILES: C1N2C3C4N(C2=O)CN5C6C7N(C5=O)CN8C9C2N(C8=O)CN5C8C%10N(C5=O)CN5C%11C%12N(C5=O)C...
eupmc
base
t2_Cucurbit[6]uril_5
task2
A
Hexamethylenediamine
[ "Hexamethylenediamine", "Propane-d8", "Potassium chloride", "Coptisine" ]
[ 6.4201, 5.2041, 3.8081, 4.1072 ]
Cucurbit[6]uril
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 Cucurbit[6]uril (SMILES: C1N2C3C4N(C2=O)CN5C6C7N(C5=O)CN8C9C2N(C8=O)CN5C8C%10N(C5=O)CN5C%11C%12N(C5=O)C...
eupmc
base
t2_Cucurbit[6]uril_6
task2
C
cylopenthylmethanaminium
[ "3-trimethylsilylpropionic -2,2,3,3-d4-acid", "1-Heptylamine (fully protonated)", "cylopenthylmethanaminium", "Rubidium cation" ]
[ 1, 3.7634, 5.7322, 2.68 ]
Cucurbit[6]uril
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 Cucurbit[6]uril (SMILES: C1N2C3C4N(C2=O)CN5C6C7N(C5=O)CN8C9C2N(C8=O)CN5C8C%10N(C5=O)CN5C%11C%12N(C5=O)C...
eupmc
base
t2_Cucurbit[6]uril_7
task2
D
Hexylamine (protonated form)
[ "Iron(III) chloride", "4-Methylbenzylamine", "(Aminomethyl)trimethylsilane", "Hexylamine (protonated form)" ]
[ 5.1703, 2.7898, 1, 5.2227 ]
Cucurbit[6]uril
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 Cucurbit[6]uril (SMILES: C1N2C3C4N(C2=O)CN5C6C7N(C5=O)CN8C9C2N(C8=O)CN5C8C%10N(C5=O)CN5C%11C%12N(C5=O)C...
eupmc
base
t2_Cucurbit[6]uril_8
task2
A
trans-4-[4-(Dimethylamino)styryl]-1-methylpyridinium iodide
[ "trans-4-[4-(Dimethylamino)styryl]-1-methylpyridinium iodide", "4-Methylbenzylamine", "1-methyl-3-propylimidazol-1-ium;bromide", "(Aminomethyl)trimethylsilane" ]
[ 6.9025, 2.7898, 4, 1 ]
Cucurbit[6]uril
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 Cucurbit[6]uril (SMILES: C1N2C3C4N(C2=O)CN5C6C7N(C5=O)CN8C9C2N(C8=O)CN5C8C%10N(C5=O)CN5C%11C%12N(C5=O)C...
eupmc
base
t2_Cucurbit[6]uril_9
task2
D
Sulfur hexafluoride
[ "1-Octanoic acid", "Cyclopentanone", "1-Hexanol", "Sulfur hexafluoride" ]
[ 2.7482, 3.2041, 2.7076, 4.4914 ]
Cucurbit[6]uril
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 Cucurbit[6]uril (SMILES: C1N2C3C4N(C2=O)CN5C6C7N(C5=O)CN8C9C2N(C8=O)CN5C8C%10N(C5=O)CN5C%11C%12N(C5=O)C...
eupmc
base
t2_Cucurbit[6]uril_10
task2
C
1-methyl-3-pentylimidazol-1-ium bromide
[ "3-methylbutan-1-aminium", "Magnesium chloride", "1-methyl-3-pentylimidazol-1-ium bromide", "1-hexyl-3-methylimidazol-3-ium;bromide" ]
[ 4.5527, 2.57, 5.3424, 4.5378 ]
Cucurbit[6]uril
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 Cucurbit[6]uril (SMILES: C1N2C3C4N(C2=O)CN5C6C7N(C5=O)CN8C9C2N(C8=O)CN5C8C%10N(C5=O)CN5C%11C%12N(C5=O)C...
eupmc
base
t2_Cucurbit[6]uril_11
task2
B
Spermidine (fully protonated form)
[ "L-Alanine", "Spermidine (fully protonated form)", "Glutathione", "benzylazanium" ]
[ 3.0199, 8.6128, 2.74, 2.4318 ]
Cucurbit[6]uril
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 Cucurbit[6]uril (SMILES: C1N2C3C4N(C2=O)CN5C6C7N(C5=O)CN8C9C2N(C8=O)CN5C8C%10N(C5=O)CN5C%11C%12N(C5=O)C...
eupmc
base
t2_Cucurbit[6]uril_12
task2
D
Strontium chloride hexahydrate
[ "Calcium chloride", "p-tolylmethanaminium", "Glycylglycine", "Strontium chloride hexahydrate" ]
[ 4.2201, 2.7185, 2.9, 4.9101 ]
Cucurbit[6]uril
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 Cucurbit[6]uril (SMILES: C1N2C3C4N(C2=O)CN5C6C7N(C5=O)CN8C9C2N(C8=O)CN5C8C%10N(C5=O)CN5C%11C%12N(C5=O)C...
eupmc
base
t2_Cucurbit[6]uril_13
task2
B
cyclobutylmethanaminium
[ "L-Valine", "cyclobutylmethanaminium", "Sodium chloride", "butylamine (protonated form)" ]
[ 3.1501, 5.778, 3.89, 5 ]
Cucurbit[6]uril
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 Cucurbit[6]uril (SMILES: C1N2C3C4N(C2=O)CN5C6C7N(C5=O)CN8C9C2N(C8=O)CN5C8C%10N(C5=O)CN5C%11C%12N(C5=O)C...
eupmc
base
t2_Cucurbit[6]uril_14
task2
B
Spermidine (fully protonated form)
[ "ethane", "Spermidine (fully protonated form)", "l-leucyl-l-phenylalanine", "Iron(III) chloride" ]
[ 3.8976, 8.6128, 2.78, 5.1703 ]
Cucurbit[6]uril
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 Cucurbit[6]uril (SMILES: C1N2C3C4N(C2=O)CN5C6C7N(C5=O)CN8C9C2N(C8=O)CN5C8C%10N(C5=O)CN5C%11C%12N(C5=O)C...
eupmc
base
t2_Cucurbit[6]uril_15
task2
D
1-(2-carboxyethyl)-3,5-dimethyl-Pyridinium
[ "Calcium cation", "3-aminopropanoic acid", "Zinc chloride", "1-(2-carboxyethyl)-3,5-dimethyl-Pyridinium" ]
[ 2.8, 3.37, 2.45, 4.4472 ]
Cucurbit[6]uril
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 Cucurbit[6]uril (SMILES: C1N2C3C4N(C2=O)CN5C6C7N(C5=O)CN8C9C2N(C8=O)CN5C8C%10N(C5=O)CN5C%11C%12N(C5=O)C...
eupmc
base
t2_Cucurbit[6]uril_16
task2
C
Iron(III) chloride
[ "4-Methylaniline", "4-(Aminomethyl)pyridine", "Iron(III) chloride", "Lithium chloride" ]
[ 3.9533, 3.4771, 5.1703, 2.41 ]
Cucurbit[6]uril
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 Cucurbit[6]uril (SMILES: C1N2C3C4N(C2=O)CN5C6C7N(C5=O)CN8C9C2N(C8=O)CN5C8C%10N(C5=O)CN5C%11C%12N(C5=O)C...
eupmc
base
t2_Cucurbit[6]uril_17
task2
C
Xenon
[ "6-aminohexan-1-ol", "Calcium cation", "Xenon", "Potassium cation" ]
[ 2.27, 2.8, 3.4889, 2.79 ]
Cucurbit[6]uril
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 Cucurbit[6]uril (SMILES: C1N2C3C4N(C2=O)CN5C6C7N(C5=O)CN8C9C2N(C8=O)CN5C8C%10N(C5=O)CN5C%11C%12N(C5=O)C...
eupmc
base
t2_Cucurbit[6]uril_18
task2
B
Glutathione
[ "m-tolylmethanaminium", "Glutathione", "11-aminoundecanoic acid", "1-propanol" ]
[ 1.5108, 2.74, 2.305, 2.5584 ]
Cucurbit[6]uril
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 Cucurbit[6]uril (SMILES: C1N2C3C4N(C2=O)CN5C6C7N(C5=O)CN8C9C2N(C8=O)CN5C8C%10N(C5=O)CN5C%11C%12N(C5=O)C...
eupmc
base
t2_Cucurbit[6]uril_19
task2
B
[2,2'-bipyridin]-5-amine
[ "3-aminopropanenitrile", "[2,2'-bipyridin]-5-amine", "1-hexyl-3-methylimidazol-3-ium;bromide", "ethane" ]
[ 2.64, 5.2833, 4.5378, 3.8976 ]
Cucurbit[6]uril
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 Cucurbit[6]uril (SMILES: C1N2C3C4N(C2=O)CN5C6C7N(C5=O)CN8C9C2N(C8=O)CN5C8C%10N(C5=O)CN5C%11C%12N(C5=O)C...
eupmc
base
t2_Cucurbit[6]uril_20
task2
A
Glycyl-l-valine
[ "Glycyl-l-valine", "m-Phenylenediamine", "6-aminohexan-1-ol", "Nonanoic acid" ]
[ 3.1901, 1, 2.27, 2.7924 ]
Cucurbit[6]uril
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 Cucurbit[6]uril (SMILES: C1N2C3C4N(C2=O)CN5C6C7N(C5=O)CN8C9C2N(C8=O)CN5C8C%10N(C5=O)CN5C%11C%12N(C5=O)C...
eupmc
base
t2_Cucurbit[6]uril_21
task2
B
Iron(III) chloride
[ "Ethanolamine", "Iron(III) chloride", "Calcium chloride", "butylamine (protonated form)" ]
[ 2.58, 5.1703, 4.2201, 5 ]
Cucurbit[6]uril
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 Cucurbit[6]uril (SMILES: C1N2C3C4N(C2=O)CN5C6C7N(C5=O)CN8C9C2N(C8=O)CN5C8C%10N(C5=O)CN5C%11C%12N(C5=O)C...
eupmc
base
t2_Cucurbit[6]uril_22
task2
C
cylopenthylmethanaminium
[ "3-aminopropanoic acid", "Xenon", "cylopenthylmethanaminium", "m-Phenylenediamine" ]
[ 3.37, 3.4889, 5.7322, 1 ]
Cucurbit[6]uril
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 Cucurbit[6]uril (SMILES: C1N2C3C4N(C2=O)CN5C6C7N(C5=O)CN8C9C2N(C8=O)CN5C8C%10N(C5=O)CN5C%11C%12N(C5=O)C...
eupmc
base
t2_Cucurbit[6]uril_23
task2
A
1-hexyl-3-methylimidazol-3-ium;bromide
[ "1-hexyl-3-methylimidazol-3-ium;bromide", "Ytterbium(III) chloride", "6-phenylpyridin-3-amine", "l-Leucyl-l-Valine" ]
[ 4.5378, 3.5, 4.1987, 2.79 ]
Cucurbit[6]uril
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 Cucurbit[6]uril (SMILES: C1N2C3C4N(C2=O)CN5C6C7N(C5=O)CN8C9C2N(C8=O)CN5C8C%10N(C5=O)CN5C%11C%12N(C5=O)C...
eupmc
base
t2_Cucurbit[6]uril_24
task2
D
Hexamethylenediamine
[ "Glycyl-l-alanine", "1-(2-carboxyethyl)-3,5-dimethyl-Pyridinium", "Calcium chloride", "Hexamethylenediamine" ]
[ 2.8, 4.4472, 4.2201, 6.4201 ]
Cucurbit[6]uril
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 Cucurbit[6]uril (SMILES: C1N2C3C4N(C2=O)CN5C6C7N(C5=O)CN8C9C2N(C8=O)CN5C8C%10N(C5=O)CN5C%11C%12N(C5=O)C...
eupmc
base
t2_Cucurbit[6]uril_25
task2
D
Barium chloride
[ "Sanguinarine", "Glycine", "Aluminum trichloride", "Barium chloride" ]
[ 3.828, 3.67, 3.81, 5.29 ]
Cucurbit[6]uril
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 Cucurbit[6]uril (SMILES: C1N2C3C4N(C2=O)CN5C6C7N(C5=O)CN8C9C2N(C8=O)CN5C8C%10N(C5=O)CN5C%11C%12N(C5=O)C...
eupmc
base
t2_Cucurbit[6]uril_26
task2
D
1-methyl-3-octylimidazol-1-ium;bromide
[ "Ethanolamine", "Magnesium chloride", "1-Pentyl-3-methylmidazolium", "1-methyl-3-octylimidazol-1-ium;bromide" ]
[ 2.58, 2.57, 0, 4 ]
Cucurbit[6]uril
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 Cucurbit[6]uril (SMILES: C1N2C3C4N(C2=O)CN5C6C7N(C5=O)CN8C9C2N(C8=O)CN5C8C%10N(C5=O)CN5C%11C%12N(C5=O)C...
eupmc
base
t2_Cucurbit[6]uril_27
task2
A
3-methylbutan-1-aminium
[ "3-methylbutan-1-aminium", "m-Phenylenediamine", "Trifluoroacetic acid", "Urea" ]
[ 4.5527, 1, 1.0414, 1.66 ]
Cucurbit[6]uril
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 Cucurbit[6]uril (SMILES: C1N2C3C4N(C2=O)CN5C6C7N(C5=O)CN8C9C2N(C8=O)CN5C8C%10N(C5=O)CN5C%11C%12N(C5=O)C...
eupmc
base
t2_Cucurbit[6]uril_28
task2
D
L-Alanine
[ "1-Ethyl-3-methylmidazolium bromide", "Cyclohexanemethylamine", "Dimethyl-(4-methylphenyl)sulfanium", "L-Alanine" ]
[ 0, 2.2261, 1, 3.0199 ]
Cucurbit[6]uril
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 Cucurbit[6]uril (SMILES: C1N2C3C4N(C2=O)CN5C6C7N(C5=O)CN8C9C2N(C8=O)CN5C8C%10N(C5=O)CN5C%11C%12N(C5=O)C...
eupmc
base
t2_Cucurbit[6]uril_29
task2
C
1-hexyl-3-methylimidazol-3-ium;bromide
[ "Zinc chloride", "Hexanoic acid", "1-hexyl-3-methylimidazol-3-ium;bromide", "Glycyl-l-alanine" ]
[ 2.45, 2.7709, 4.5378, 2.8 ]
Cucurbit[6]uril
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 Cucurbit[6]uril (SMILES: C1N2C3C4N(C2=O)CN5C6C7N(C5=O)CN8C9C2N(C8=O)CN5C8C%10N(C5=O)CN5C%11C%12N(C5=O)C...
eupmc
base
t2_Cucurbit[6]uril_30
task2
D
Spermidine (fully protonated form)
[ "Lanthanum chloride heptahydrate", "Ethyne", "Zinc chloride", "Spermidine (fully protonated form)" ]
[ 4.1614, 1.8567, 2.45, 8.6128 ]
Cucurbit[6]uril
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 Cucurbit[6]uril (SMILES: C1N2C3C4N(C2=O)CN5C6C7N(C5=O)CN8C9C2N(C8=O)CN5C8C%10N(C5=O)CN5C%11C%12N(C5=O)C...
eupmc
base
t2_Cucurbit[6]uril_31
task2
C
Dimethyl sulfoxide
[ "Nonanoic acid", "Hexanoic acid", "Dimethyl sulfoxide", "Acetic acid" ]
[ 2.7924, 2.7709, 3.0792, 2.1761 ]
Cucurbit[6]uril
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 Cucurbit[6]uril (SMILES: C1N2C3C4N(C2=O)CN5C6C7N(C5=O)CN8C9C2N(C8=O)CN5C8C%10N(C5=O)CN5C%11C%12N(C5=O)C...
eupmc
base
t2_Cucurbit[6]uril_32
task2
C
1-methyl-3-pentylimidazol-1-ium bromide
[ "Cyclohexylmethanaminium", "Aluminum trichloride", "1-methyl-3-pentylimidazol-1-ium bromide", "Acetone" ]
[ 1.9869, 3.81, 5.3424, 3.8573 ]
Cucurbit[6]uril
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 Cucurbit[6]uril (SMILES: C1N2C3C4N(C2=O)CN5C6C7N(C5=O)CN8C9C2N(C8=O)CN5C8C%10N(C5=O)CN5C%11C%12N(C5=O)C...
eupmc
base
t2_Cucurbit[6]uril_33
task2
C
4-Methylaniline
[ "Lithium ion", "4-aminobutan-1-ol", "4-Methylaniline", "Cyclopentanone" ]
[ 2.38, 3.34, 3.9533, 3.2041 ]
Cucurbit[6]uril
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 Cucurbit[6]uril (SMILES: C1N2C3C4N(C2=O)CN5C6C7N(C5=O)CN8C9C2N(C8=O)CN5C8C%10N(C5=O)CN5C%11C%12N(C5=O)C...
eupmc
base
t2_Cucurbit[6]uril_34
task2
A
glycyl-l-asparagine
[ "glycyl-l-asparagine", "1-Ethyl-3-methylmidazolium bromide", "benzylazanium", "Cyclohexanemethylamine" ]
[ 2.82, 0, 2.4318, 2.2261 ]
Cucurbit[6]uril
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 Cucurbit[6]uril (SMILES: C1N2C3C4N(C2=O)CN5C6C7N(C5=O)CN8C9C2N(C8=O)CN5C8C%10N(C5=O)CN5C%11C%12N(C5=O)C...
eupmc
base
t2_Cucurbit[6]uril_35
task2
A
L-Phenylalanine
[ "L-Phenylalanine", "Propionic acid", "Nickel chloride", "Glycyl-l-leucine" ]
[ 3.16, 2.7709, 2.59, 2.57 ]
Cucurbit[6]uril
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 Cucurbit[6]uril (SMILES: C1N2C3C4N(C2=O)CN5C6C7N(C5=O)CN8C9C2N(C8=O)CN5C8C%10N(C5=O)CN5C%11C%12N(C5=O)C...
eupmc
base
t2_Cucurbit[6]uril_36
task2
A
Butylamine (protonated form)
[ "Butylamine (protonated form)", "p-tolylmethanaminium", "propiononitrile", "1-heptanoic acid" ]
[ 6.4914, 2.7185, 2.57, 2.7709 ]
Cucurbit[6]uril
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 Cucurbit[6]uril (SMILES: C1N2C3C4N(C2=O)CN5C6C7N(C5=O)CN8C9C2N(C8=O)CN5C8C%10N(C5=O)CN5C%11C%12N(C5=O)C...
eupmc
base
t2_Cucurbit[6]uril_37
task2
D
6-aminohexanoic acid
[ "propiononitrile", "Glycyl-l-alanine", "3,3-dimethylbutan-1-aminium", "6-aminohexanoic acid" ]
[ 2.57, 2.8, 1.244, 3.57 ]
Cucurbit[6]uril
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 Cucurbit[6]uril (SMILES: C1N2C3C4N(C2=O)CN5C6C7N(C5=O)CN8C9C2N(C8=O)CN5C8C%10N(C5=O)CN5C%11C%12N(C5=O)C...
eupmc
base
t2_Cucurbit[6]uril_38
task2
B
Acetone
[ "1-Ethyl-3-methylmidazolium bromide", "Acetone", "Propionic acid", "P-Xylylenediamine" ]
[ 0, 3.8573, 2.7709, 2.7404 ]
Cucurbit[6]uril
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 Cucurbit[6]uril (SMILES: C1N2C3C4N(C2=O)CN5C6C7N(C5=O)CN8C9C2N(C8=O)CN5C8C%10N(C5=O)CN5C%11C%12N(C5=O)C...
eupmc
base
t2_Cucurbit[6]uril_39
task2
C
Lanthanum chloride heptahydrate
[ "5-aminopentan-1-ol", "1-Butanol", "Lanthanum chloride heptahydrate", "m-Phenylenediamine" ]
[ 2.84, 2.8089, 4.1614, 1 ]
Cucurbit[6]uril
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 Cucurbit[6]uril (SMILES: C1N2C3C4N(C2=O)CN5C6C7N(C5=O)CN8C9C2N(C8=O)CN5C8C%10N(C5=O)CN5C%11C%12N(C5=O)C...
eupmc
base
t2_Cucurbit[6]uril_40
task2
C
cylopenthylmethanaminium
[ "Lithium ion", "Glycyl-l-leucine", "cylopenthylmethanaminium", "3-aminopropanenitrile" ]
[ 2.38, 2.57, 5.7322, 2.64 ]
Cucurbit[6]uril
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 Cucurbit[6]uril (SMILES: C1N2C3C4N(C2=O)CN5C6C7N(C5=O)CN8C9C2N(C8=O)CN5C8C%10N(C5=O)CN5C%11C%12N(C5=O)C...
eupmc
base
t2_Cucurbit[6]uril_41
task2
C
ethane
[ "benzylazanium", "Potassium cation", "ethane", "1-Octanoic acid" ]
[ 2.4318, 2.79, 3.8976, 2.7482 ]
Cucurbit[6]uril
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 Cucurbit[6]uril (SMILES: C1N2C3C4N(C2=O)CN5C6C7N(C5=O)CN8C9C2N(C8=O)CN5C8C%10N(C5=O)CN5C%11C%12N(C5=O)C...
eupmc
base
t2_Cucurbit[6]uril_42
task2
B
1-heptyl-3-methylimidazol-3-ium bromide
[ "glycyl-l-asparagine", "1-heptyl-3-methylimidazol-3-ium bromide", "(Aminomethyl)trimethylsilane", "Potassium chloride" ]
[ 2.82, 4, 1, 3.8081 ]
Cucurbit[6]uril
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 Cucurbit[6]uril (SMILES: C1N2C3C4N(C2=O)CN5C6C7N(C5=O)CN8C9C2N(C8=O)CN5C8C%10N(C5=O)CN5C%11C%12N(C5=O)C...
eupmc
base
t2_Cucurbit[6]uril_43
task2
D
[2,2'-bipyridin]-5-amine
[ "8-aminooctanoic acid", "Ethyne", "propiononitrile", "[2,2'-bipyridin]-5-amine" ]
[ 3.27, 1.8567, 2.57, 5.2833 ]
Cucurbit[6]uril
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 Cucurbit[6]uril (SMILES: C1N2C3C4N(C2=O)CN5C6C7N(C5=O)CN8C9C2N(C8=O)CN5C8C%10N(C5=O)CN5C%11C%12N(C5=O)C...
eupmc
base
t2_Cucurbit[6]uril_44
task2
C
(1R,4R)-cyclohexane-1,4-diamine
[ "3-trimethylsilylpropionic -2,2,3,3-d4-acid", "2,3-Diazabicyclo[2.2.1]-hept-2-ene", "(1R,4R)-cyclohexane-1,4-diamine", "3-aminopropanenitrile" ]
[ 1, 3.1139, 6.1461, 2.64 ]
Cucurbit[6]uril
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 Cucurbit[6]uril (SMILES: C1N2C3C4N(C2=O)CN5C6C7N(C5=O)CN8C9C2N(C8=O)CN5C8C%10N(C5=O)CN5C%11C%12N(C5=O)C...
eupmc
base
t2_Cucurbit[6]uril_45
task2
B
Strontium chloride hexahydrate
[ "1-Hexanol", "Strontium chloride hexahydrate", "m-Phenylenediamine", "1-Pentanol" ]
[ 2.7076, 4.9101, 1, 2.6726 ]
Cucurbit[6]uril
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 Cucurbit[6]uril (SMILES: C1N2C3C4N(C2=O)CN5C6C7N(C5=O)CN8C9C2N(C8=O)CN5C8C%10N(C5=O)CN5C%11C%12N(C5=O)C...
eupmc
base
t2_Cucurbit[6]uril_46
task2
C
Butylamine (protonated form)
[ "Lanthanum chloride heptahydrate", "1-Pentanol", "Butylamine (protonated form)", "6-aminohexan-1-ol" ]
[ 4.1614, 2.6726, 6.4914, 2.27 ]
Cucurbit[6]uril
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 Cucurbit[6]uril (SMILES: C1N2C3C4N(C2=O)CN5C6C7N(C5=O)CN8C9C2N(C8=O)CN5C8C%10N(C5=O)CN5C%11C%12N(C5=O)C...
eupmc
base
t2_Cucurbit[6]uril_47
task2
B
thiophen-2-ylmethanaminium
[ "Cesium chloride, Caesium chloride", "thiophen-2-ylmethanaminium", "6-aminohexanoic acid", "5-aminopentan-1-ol" ]
[ 5.3096, 5.5772, 3.57, 2.84 ]
Cucurbit[6]uril
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 Cucurbit[6]uril (SMILES: C1N2C3C4N(C2=O)CN5C6C7N(C5=O)CN8C9C2N(C8=O)CN5C8C%10N(C5=O)CN5C%11C%12N(C5=O)C...
eupmc
base
t2_Cucurbit[6]uril_48
task2
C
1-Octylammonium
[ "P-Xylylenediamine", "p-Phenylenediamine", "1-Octylammonium", "Rubidium cation" ]
[ 2.7404, 3.2695, 3.3222, 2.68 ]
Cucurbit[6]uril
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 Cucurbit[6]uril (SMILES: C1N2C3C4N(C2=O)CN5C6C7N(C5=O)CN8C9C2N(C8=O)CN5C8C%10N(C5=O)CN5C%11C%12N(C5=O)C...
eupmc
base
t2_Cucurbit[6]uril_49
task2
D
Cesium chloride, Caesium chloride
[ "1-Butanol", "5-aminopentan-1-ol", "1-methyl-3-octylimidazol-1-ium;bromide", "Cesium chloride, Caesium chloride" ]
[ 2.8089, 2.84, 4, 5.3096 ]
Cucurbit[6]uril
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 Cucurbit[6]uril (SMILES: C1N2C3C4N(C2=O)CN5C6C7N(C5=O)CN8C9C2N(C8=O)CN5C8C%10N(C5=O)CN5C%11C%12N(C5=O)C...
eupmc
base
t2_Cucurbit[6]uril_50
task2
C
3-methylbutan-1-aminium
[ "Glycylhistidine", "l-leucyl-l-phenylalanine", "3-methylbutan-1-aminium", "glycyl-l-asparagine" ]
[ 2.79, 2.78, 4.5527, 2.82 ]
Cucurbit[6]uril
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 Cucurbit[6]uril (SMILES: C1N2C3C4N(C2=O)CN5C6C7N(C5=O)CN8C9C2N(C8=O)CN5C8C%10N(C5=O)CN5C%11C%12N(C5=O)C...
eupmc
base
t2_Cucurbit[6]uril_51
task2
A
Iron(III) chloride
[ "Iron(III) chloride", "1-heptanoic acid", "4-aminobutan-1-ol", "Glycyl-l-leucine" ]
[ 5.1703, 2.7709, 3.34, 2.57 ]
Cucurbit[6]uril
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 Cucurbit[6]uril (SMILES: C1N2C3C4N(C2=O)CN5C6C7N(C5=O)CN8C9C2N(C8=O)CN5C8C%10N(C5=O)CN5C%11C%12N(C5=O)C...
eupmc
base
t2_Cucurbit[6]uril_52
task2
D
Silver chloride
[ "Potassium chloride", "Ethanolamine", "Dimethyl-(4-methylphenyl)sulfanium", "Silver chloride" ]
[ 3.8081, 2.58, 1, 3.87 ]
Cucurbit[6]uril
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 Cucurbit[6]uril (SMILES: C1N2C3C4N(C2=O)CN5C6C7N(C5=O)CN8C9C2N(C8=O)CN5C8C%10N(C5=O)CN5C%11C%12N(C5=O)C...
eupmc
base
t2_Cucurbit[6]uril_53
task2
C
Isobutane-d10
[ "3-aminopropan-1-ol", "o-tolylmethanaminium", "Isobutane-d10", "Pyrrole" ]
[ 3.5899, 1.5108, 5.959, 4.5563 ]
Cucurbit[6]uril
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 Cucurbit[6]uril (SMILES: C1N2C3C4N(C2=O)CN5C6C7N(C5=O)CN8C9C2N(C8=O)CN5C8C%10N(C5=O)CN5C%11C%12N(C5=O)C...
eupmc
base
t2_Cucurbit[6]uril_54
task2
D
Sanguinarine
[ "4-aminobutyric acid", "l-Leucyl-l-Tryptophan", "5-aminopentan-1-ol", "Sanguinarine" ]
[ 3.4, 2.92, 2.84, 3.828 ]
Cucurbit[6]uril
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 Cucurbit[6]uril (SMILES: C1N2C3C4N(C2=O)CN5C6C7N(C5=O)CN8C9C2N(C8=O)CN5C8C%10N(C5=O)CN5C%11C%12N(C5=O)C...
eupmc
base
t2_Cucurbit[6]uril_55
task2
B
Lanthanum chloride heptahydrate
[ "Silver chloride", "Lanthanum chloride heptahydrate", "Dimethyl-(4-methylphenyl)sulfanium", "Ethyne" ]
[ 3.87, 4.1614, 1, 1.8567 ]
Cucurbit[6]uril
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 Cucurbit[6]uril (SMILES: C1N2C3C4N(C2=O)CN5C6C7N(C5=O)CN8C9C2N(C8=O)CN5C8C%10N(C5=O)CN5C%11C%12N(C5=O)C...
eupmc
base
t2_Cucurbit[6]uril_56
task2
C
4-aminobutan-1-ol
[ "4-Methylbenzylamine", "1-Butanol", "4-aminobutan-1-ol", "Strontium cation" ]
[ 2.7898, 2.8089, 3.34, 3.1801 ]
Cucurbit[6]uril
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 Cucurbit[6]uril (SMILES: C1N2C3C4N(C2=O)CN5C6C7N(C5=O)CN8C9C2N(C8=O)CN5C8C%10N(C5=O)CN5C%11C%12N(C5=O)C...
eupmc
base
t2_Cucurbit[6]uril_57
task2
B
N-Butyladamantan-1-aminium
[ "Barium chloride", "N-Butyladamantan-1-aminium", "4-Methylaniline", "Isobutane-d10" ]
[ 5.29, 7.301, 3.9533, 5.959 ]
Cucurbit[6]uril
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 Cucurbit[6]uril (SMILES: C1N2C3C4N(C2=O)CN5C6C7N(C5=O)CN8C9C2N(C8=O)CN5C8C%10N(C5=O)CN5C%11C%12N(C5=O)C...
eupmc
base
t2_Cucurbit[6]uril_58
task2
C
1-hexyl-3-methylimidazol-3-ium;bromide
[ "1-propanol", "l-leucyl-l-phenylalanine", "1-hexyl-3-methylimidazol-3-ium;bromide", "Aluminum trichloride" ]
[ 2.5584, 2.78, 4.5378, 3.81 ]
Cucurbit[6]uril
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 Cucurbit[6]uril (SMILES: C1N2C3C4N(C2=O)CN5C6C7N(C5=O)CN8C9C2N(C8=O)CN5C8C%10N(C5=O)CN5C%11C%12N(C5=O)C...
eupmc
base
t2_Cucurbit[6]uril_59
task2
C
ethane
[ "L-Phenylalanine", "1-Octanoic acid", "ethane", "Glycylhistidine" ]
[ 3.16, 2.7482, 3.8976, 2.79 ]
Cucurbit[6]uril
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 Cucurbit[6]uril (SMILES: C1N2C3C4N(C2=O)CN5C6C7N(C5=O)CN8C9C2N(C8=O)CN5C8C%10N(C5=O)CN5C%11C%12N(C5=O)C...
eupmc
base
t2_Cucurbit[6]uril_60
task2
B
Butylamine (protonated form)
[ "Calcium chloride", "Butylamine (protonated form)", "Acetic acid", "L-Alanine" ]
[ 4.2201, 6.4914, 2.1761, 3.0199 ]
Cucurbit[6]uril
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 Cucurbit[6]uril (SMILES: C1N2C3C4N(C2=O)CN5C6C7N(C5=O)CN8C9C2N(C8=O)CN5C8C%10N(C5=O)CN5C%11C%12N(C5=O)C...
eupmc
base
t2_Cucurbit[6]uril_61
task2
B
Butylamine (protonated form)
[ "Rubidium cation", "Butylamine (protonated form)", "6-Phenylamino-naphthalene-2-sulfonic acid anion", "1-Pentanoic acid" ]
[ 2.68, 6.4914, 1.716, 2.699 ]
Cucurbit[6]uril
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 Cucurbit[6]uril (SMILES: C1N2C3C4N(C2=O)CN5C6C7N(C5=O)CN8C9C2N(C8=O)CN5C8C%10N(C5=O)CN5C%11C%12N(C5=O)C...
eupmc
base
t2_Cucurbit[6]uril_62
task2
D
Potassium chloride
[ "1-Hexanol", "1-Butanol", "5-aminovaleric acid", "Potassium chloride" ]
[ 2.7076, 2.8089, 3.5899, 3.8081 ]
Cucurbit[6]uril
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 Cucurbit[6]uril (SMILES: C1N2C3C4N(C2=O)CN5C6C7N(C5=O)CN8C9C2N(C8=O)CN5C8C%10N(C5=O)CN5C%11C%12N(C5=O)C...
eupmc
base
t2_Cucurbit[6]uril_63
task2
C
1-dodecyl-3-methylimidazol-3-ium bromide
[ "Zinc chloride", "L-Valine", "1-dodecyl-3-methylimidazol-3-ium bromide", "5-aminovaleric acid" ]
[ 2.45, 3.1501, 4, 3.5899 ]
Cucurbit[6]uril
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 Cucurbit[6]uril (SMILES: C1N2C3C4N(C2=O)CN5C6C7N(C5=O)CN8C9C2N(C8=O)CN5C8C%10N(C5=O)CN5C%11C%12N(C5=O)C...
eupmc
base
t2_Cucurbit[6]uril_64
task2
A
Cesium chloride, Caesium chloride
[ "Cesium chloride, Caesium chloride", "1-Heptylamine (fully protonated)", "3-trimethylsilylpropionic -2,2,3,3-d4-acid", "L-Alanine" ]
[ 5.3096, 3.7634, 1, 3.0199 ]
Cucurbit[6]uril
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 Cucurbit[6]uril (SMILES: C1N2C3C4N(C2=O)CN5C6C7N(C5=O)CN8C9C2N(C8=O)CN5C8C%10N(C5=O)CN5C%11C%12N(C5=O)C...
eupmc
base
t2_Cucurbit[6]uril_65
task2
D
Acetone
[ "propiononitrile", "Cyclohexylmethanaminium", "3,3-dimethylbutan-1-aminium", "Acetone" ]
[ 2.57, 1.9869, 1.244, 3.8573 ]
Cucurbit[6]uril
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 Cucurbit[6]uril (SMILES: C1N2C3C4N(C2=O)CN5C6C7N(C5=O)CN8C9C2N(C8=O)CN5C8C%10N(C5=O)CN5C%11C%12N(C5=O)C...
eupmc
base
t2_Cucurbit[6]uril_66
task2
B
Isobutane-d10
[ "L-Phenylalanine", "Isobutane-d10", "Strontium chloride hexahydrate", "dl-leucylglycyl-dl-phenylalanine" ]
[ 3.16, 5.959, 4.9101, 2.8 ]
Cucurbit[6]uril
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 Cucurbit[6]uril (SMILES: C1N2C3C4N(C2=O)CN5C6C7N(C5=O)CN8C9C2N(C8=O)CN5C8C%10N(C5=O)CN5C%11C%12N(C5=O)C...
eupmc
base
t2_Cucurbit[6]uril_67
task2
A
cyclobutylmethanaminium
[ "cyclobutylmethanaminium", "Glycyl-l-leucine", "1-heptanoic acid", "3-trimethylsilylpropionic -2,2,3,3-d4-acid" ]
[ 5.778, 2.57, 2.7709, 1 ]
Cucurbit[6]uril
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 Cucurbit[6]uril (SMILES: C1N2C3C4N(C2=O)CN5C6C7N(C5=O)CN8C9C2N(C8=O)CN5C8C%10N(C5=O)CN5C%11C%12N(C5=O)C...
eupmc
base