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t2_Cucurbit[7]uril_136
task2
B
6-Methoxy-1-methylquinolinium
[ "Phosphoramidon", "6-Methoxy-1-methylquinolinium", "Glycyl-dl-Tryptophan", "1-Methyl-4-(pyridin-4-yl)pyridinium" ]
[ 3.2826, 6.2996, 2.4472, 6.0792 ]
Cucurbit[7]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[7]uril in aqueous solution at standard conditions? A. Phosphoramidon (SMILES: CC1C(C(C(C(O1)O...
cb7_supplement
base
t2_Cucurbit[7]uril_137
task2
A
(Trimethylamino)methyl)ferrocene
[ "(Trimethylamino)methyl)ferrocene", "6-chloro-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole", "(2S)-2-((2S)-2-((2S)-2-(2-((3R)-2-amino-3-hydroxybutanamido)acetamido)propanamido)-3-phenylpropanamido)-4-methylpentanamide", "6-Phenylamino-naphthalene-2-sulfonic acid anion" ]
[ 12.6075, 6.7993, 3.7475, 2.7782 ]
Cucurbit[7]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[7]uril in aqueous solution at standard conditions? A. (Trimethylamino)methyl)ferrocene (SMILE...
cb7_supplement
base
t2_Cucurbit[7]uril_138
task2
B
1,1'-bis(3-aminopropyl)-4,4'-bipyridinium
[ "Tyrosyl-Glycine", "1,1'-bis(3-aminopropyl)-4,4'-bipyridinium", "2NpCH2ImidMe", "Tetramethyl benzobis (imidazolium)" ]
[ 6.5563, 7.0792, 5.4771, 3.8195 ]
Cucurbit[7]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[7]uril in aqueous solution at standard conditions? A. Tyrosyl-Glycine (SMILES: C1=CC(=CC=C1CC...
cb7_supplement
base
t2_Cucurbit[7]uril_139
task2
D
2,3-Diazabicyclo(2.2.2)oct-2-ene
[ "7,8-dimethyl-1H-benzo[g]pteridine-2,4-dione", "Rubidium chloride", "Thr-Gly-D-Ala-Phe-Met-NH2", "2,3-Diazabicyclo(2.2.2)oct-2-ene" ]
[ 3.9685, 3.425, 4.6184, 7.1271 ]
Cucurbit[7]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[7]uril in aqueous solution at standard conditions? A. 7,8-dimethyl-1H-benzo[g]pteridine-2,4-d...
cb7_supplement
base
t2_Cucurbit[7]uril_140
task2
B
1-Adamantanol
[ "1-methyl-3-octylimidazol-1-ium chloride", "1-Adamantanol", "Magnesium chloride", "Cholic acid" ]
[ 6.9494, 10.3944, 3.24, 3 ]
Cucurbit[7]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[7]uril in aqueous solution at standard conditions? A. 1-methyl-3-octylimidazol-1-ium chloride...
cb7_supplement
base
t2_Cucurbit[7]uril_141
task2
A
2,2,6-trimethylcyclohexan-1-one
[ "2,2,6-trimethylcyclohexan-1-one", "N-(furan-2-ylmethyl)propan-1-amine", "Acridine Yellow G", "Gly-tyr-gly" ]
[ 6.9489, 5.3617, 4.4364, 3.4314 ]
Cucurbit[7]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[7]uril in aqueous solution at standard conditions? A. 2,2,6-trimethylcyclohexan-1-one (SMILES...
cb7_supplement
base
t2_Cucurbit[7]uril_142
task2
D
Proflavine
[ "Tryptophyl-Glycine", "Lithium ion", "[Amino-[4-[6-[amino(azaniumylidene)methyl]-1H-indol-2-yl]phenyl]methylidene]azanium", "Proflavine" ]
[ 5.7482, 1.415, 7.0414, 7.301 ]
Cucurbit[7]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[7]uril in aqueous solution at standard conditions? A. Tryptophyl-Glycine (SMILES: C1=CC=C2C(=...
cb7_supplement
base
t2_Cucurbit[7]uril_143
task2
B
bis(Trimethylamminomethyl)ferrocene
[ "Histamine", "bis(Trimethylamminomethyl)ferrocene", "[Amino-[4-[6-[amino(azaniumylidene)methyl]-1H-indol-2-yl]phenyl]methylidene]azanium", "Sodium chloride" ]
[ 4.5051, 15.5002, 7.0414, 3.4099 ]
Cucurbit[7]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[7]uril in aqueous solution at standard conditions? A. Histamine (SMILES: C1=C(NC=N1)CCN). B. ...
cb7_supplement
base
t2_Cucurbit[7]uril_144
task2
A
1-methyl-1'-(3-aminiopropyl)-4,4'-bipyridinium
[ "1-methyl-1'-(3-aminiopropyl)-4,4'-bipyridinium", "1-(3-aminopropyl)-4-4'-bipyridinium", "1-Phenyl-2-butanone", "1,1'-(3-(methoxycarbonyl)pentane-1,5-diyl)bis(pyridin-1-ium)" ]
[ 7.1461, 6.6335, 3.6628, 0 ]
Cucurbit[7]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[7]uril in aqueous solution at standard conditions? A. 1-methyl-1'-(3-aminiopropyl)-4,4'-bipyr...
cb7_supplement
base
t2_Cucurbit[7]uril_145
task2
B
N-((5-bromofuran-2-yl)methyl)prop-2-en-1-amine
[ "Cesium cation", "N-((5-bromofuran-2-yl)methyl)prop-2-en-1-amine", "Magnesium chloride", "Rhodamine 6G" ]
[ 2.8388, 6, 3.24, 4.699 ]
Cucurbit[7]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[7]uril in aqueous solution at standard conditions? A. Cesium cation (SMILES: [Cs+]). B. N-((5...
cb7_supplement
base
t2_Cucurbit[7]uril_146
task2
B
1-hexyl-3-methylimidazol-3-ium;chloride
[ "Dopamine", "1-hexyl-3-methylimidazol-3-ium;chloride", "6-chloro-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole", "1H-​Imidazolium, 3-​butyl-​1-​methyl-​, bromide" ]
[ 5.6684, 7.301, 6.7993, 6.7993 ]
Cucurbit[7]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[7]uril in aqueous solution at standard conditions? A. Dopamine (SMILES: C1=CC(=C(C=C1CCN)O)O)...
cb7_supplement
base
t2_Cucurbit[7]uril_147
task2
A
bis(dimethylpyridinium)diarylethene (open form)
[ "bis(dimethylpyridinium)diarylethene (open form)", "1-hexyl-3-methylimidazol-3-ium;bromide", "(R)-1-(2-naphthyl)ethylammonium", "5-Bromo-2-adamantanone" ]
[ 8.8299, 7.2788, 7.0253, 8.4857 ]
Cucurbit[7]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[7]uril in aqueous solution at standard conditions? A. bis(dimethylpyridinium)diarylethene (op...
cb7_supplement
base
t2_Cucurbit[7]uril_148
task2
A
N1,N1'-(hexane-1,6-diyl)bis(ethane-1,2-diaminium)
[ "N1,N1'-(hexane-1,6-diyl)bis(ethane-1,2-diaminium)", "beta-Estradiol", "TMPyP4", "D/L-lysine" ]
[ 11.2304, 6.2504, 4.9138, 2.9395 ]
Cucurbit[7]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[7]uril in aqueous solution at standard conditions? A. N1,N1'-(hexane-1,6-diyl)bis(ethane-1,2-...
cb7_supplement
base
t2_Cucurbit[7]uril_149
task2
D
(E)-4-(2-(7-(diethylamino)-2-oxo-2H-chromen-3-yl)vinyl)-1-(3-(trimethylammonio)propyl)pyridin-1-ium bromide
[ "2-Adamantylamine hydrochloride", "(R)-1-(2-naphthyl)ethylammonium", "Oxaliplatin", "(E)-4-(2-(7-(diethylamino)-2-oxo-2H-chromen-3-yl)vinyl)-1-(3-(trimethylammonio)propyl)pyridin-1-ium bromide" ]
[ 14, 7.0253, 5.3617, 14.8899 ]
Cucurbit[7]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[7]uril in aqueous solution at standard conditions? A. 2-Adamantylamine hydrochloride (SMILES:...
cb7_supplement
base
t2_Cucurbit[7]uril_150
task2
D
((S)-2-amino-3-(4-(aminomethyl)phenyl)propanoyl)-L-methionine
[ "6-Phenylamino-naphthalene-2-sulfonic acid anion", "Ytterbium(III) chloride", "Rubidium cation", "((S)-2-amino-3-(4-(aminomethyl)phenyl)propanoyl)-L-methionine" ]
[ 2.7782, 4.42, 2.7634, 8.7243 ]
Cucurbit[7]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[7]uril in aqueous solution at standard conditions? A. 6-Phenylamino-naphthalene-2-sulfonic ac...
cb7_supplement
base
t2_Cucurbit[7]uril_151
task2
D
[Amino-[4-[6-[amino(azaniumylidene)methyl]-1H-indol-2-yl]phenyl]methylidene]azanium
[ "Rubidium chloride", "Tryptophyl-Glycine", "Diquat", "[Amino-[4-[6-[amino(azaniumylidene)methyl]-1H-indol-2-yl]phenyl]methylidene]azanium" ]
[ 3.425, 5.7482, 2.5378, 7.0414 ]
Cucurbit[7]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[7]uril in aqueous solution at standard conditions? A. Rubidium chloride (SMILES: [Cl-].[Rb+])...
cb7_supplement
base
t2_Cucurbit[7]uril_152
task2
B
Bicyclo[2.2.2]octane-1,4-diyldimethanol
[ "6-chloro-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole", "Bicyclo[2.2.2]octane-1,4-diyldimethanol", "1-(hydroxymethyl)-ferrocene", "Ferrocene" ]
[ 6.7993, 9.7853, 9.4238, 6 ]
Cucurbit[7]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[7]uril in aqueous solution at standard conditions? A. 6-chloro-1,2,3,6,7,7a-hexahydro-3a,6-ep...
cb7_supplement
base
t2_Cucurbit[7]uril_153
task2
C
1-methyl-3-octylimidazol-1-ium chloride
[ "Ethanol", "Potassium chloride", "1-methyl-3-octylimidazol-1-ium chloride", "Oxaliplatin" ]
[ 2.49, 3.375, 6.9494, 5.3617 ]
Cucurbit[7]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[7]uril in aqueous solution at standard conditions? A. Ethanol (SMILES: CCO). B. Potassium chl...
cb7_supplement
base
t2_Cucurbit[7]uril_154
task2
B
tBu Phe
[ "Zinc chloride", "tBu Phe", "Rhodamine methylester chloride", "Lithium ion" ]
[ 3.4, 6.6021, 3, 1.415 ]
Cucurbit[7]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[7]uril in aqueous solution at standard conditions? A. Zinc chloride (SMILES: Cl[Zn]Cl). B. tB...
cb7_supplement
base
t2_Cucurbit[7]uril_155
task2
D
AM Phe-Gly-Gly
[ "1-methyl-3-[[4-[4-[(3-methylimidazol-3-ium-1-yl)methyl]phenyl]phenyl]methyl]imidazol-1-ium", "1-hexyl-3-methylimidazol-3-ium;chloride", "Sodium chloride", "AM Phe-Gly-Gly" ]
[ 5.2742, 7.301, 3.4099, 9.0212 ]
Cucurbit[7]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[7]uril in aqueous solution at standard conditions? A. 1-methyl-3-[[4-[4-[(3-methylimidazol-3-...
cb7_supplement
base
t2_Cucurbit[7]uril_156
task2
C
bicyclo[2.2.1]heptan-2-one
[ "tBu Phe", "Glycyl-phenylalanine", "bicyclo[2.2.1]heptan-2-one", "(Z)‐4‐(4‐(2‐(3′,5′‐bis(trifluoromethyl)‐[1,1′‐biphenyl]‐4‐yl)‐1‐cyanovinyl)phenyl)‐1‐methylpyridin‐1‐ium chloride" ]
[ 6.6021, 3.1139, 8.1825, 6.0969 ]
Cucurbit[7]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[7]uril in aqueous solution at standard conditions? A. tBu Phe (SMILES: CC(C)(C)C1=CC=C(C=C1)C...
cb7_supplement
base
t2_Cucurbit[7]uril_157
task2
B
((S)-2-amino-3-(4-(aminomethyl)phenyl)propanoyl)-L-methionine
[ "1-methyl-1'-(3-aminiopropyl)-4,4'-bipyridinium", "((S)-2-amino-3-(4-(aminomethyl)phenyl)propanoyl)-L-methionine", "Trp-met-gly", "1-hexyl-3-methylimidazol-3-ium;chloride" ]
[ 7.1461, 8.7243, 5.3617, 7.301 ]
Cucurbit[7]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[7]uril in aqueous solution at standard conditions? A. 1-methyl-1'-(3-aminiopropyl)-4,4'-bipyr...
cb7_supplement
base
t2_Cucurbit[7]uril_158
task2
C
tBu Phe
[ "7,8-dimethyl-1H-benzo[g]pteridine-2,4-dione", "Albendazole", "tBu Phe", "Recombinant insulin human" ]
[ 3.9685, 4.8129, 6.6021, 6.1761 ]
Cucurbit[7]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[7]uril in aqueous solution at standard conditions? A. 7,8-dimethyl-1H-benzo[g]pteridine-2,4-d...
cb7_supplement
base
t2_Cucurbit[7]uril_159
task2
D
N-(furan-2-ylmethyl)prop-2-en-1-amine
[ "Copper chloride", "Aluminum cation", "Thiazole orange", "N-(furan-2-ylmethyl)prop-2-en-1-amine" ]
[ 3.75, 4.3911, 5.4472, 6.4771 ]
Cucurbit[7]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[7]uril in aqueous solution at standard conditions? A. Copper chloride (SMILES: Cl[Cu]Cl). B. ...
cb7_supplement
base
t2_Cucurbit[7]uril_160
task2
C
Cyclohexylmethanaminium
[ "1H-​Imidazolium, 3-​butyl-​1-​methyl-​, bromide", "N-((5-bromofuran-2-yl)methyl)prop-2-en-1-amine", "Cyclohexylmethanaminium", "Rhodamine 6G" ]
[ 6.7993, 6, 11.1139, 4.699 ]
Cucurbit[7]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[7]uril in aqueous solution at standard conditions? A. 1H-​Imidazolium, 3-​butyl-​1-​methyl-​,...
cb7_supplement
base
t2_Cucurbit[7]uril_161
task2
D
Phenylalanylglycine
[ "Progesterone", "Potassium chloride", "Thr-Gly-Gly-Phe-Met-NH2", "Phenylalanylglycine" ]
[ 4.7701, 3.375, 4.3495, 7.4771 ]
Cucurbit[7]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[7]uril in aqueous solution at standard conditions? A. Progesterone (SMILES: CC(=O)C1CCC2C1(CC...
cb7_supplement
base
t2_Cucurbit[7]uril_162
task2
C
2-Adamantylamine hydrochloride
[ "styrylcoumarin", "Pyrrole", "2-Adamantylamine hydrochloride", "Magnesium chloride" ]
[ 10.0792, 3.2304, 14, 3.24 ]
Cucurbit[7]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[7]uril in aqueous solution at standard conditions? A. styrylcoumarin (SMILES: CCN(c1ccc2c(c1)...
cb7_supplement
base
t2_Cucurbit[7]uril_163
task2
A
Bicyclo[2.2.2]octane-1,4-diyldimethanol
[ "Bicyclo[2.2.2]octane-1,4-diyldimethanol", "butane-1,4-diamine;dihydrochloride", "Proflavine", "Eucalyptol" ]
[ 9.7853, 5.8976, 7.301, 5.9294 ]
Cucurbit[7]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[7]uril in aqueous solution at standard conditions? A. Bicyclo[2.2.2]octane-1,4-diyldimethanol...
cb7_supplement
base
t2_Cucurbit[7]uril_164
task2
A
bis(dimethylpyridinium)diarylethene (open form)
[ "bis(dimethylpyridinium)diarylethene (open form)", "pentacyclo[7.3.1.14,12.02,7.06,11]tetradecane-4,9-diol", "Glycyl-dl-Tryptophan", "Phenylalanylglycine" ]
[ 8.8299, 7.1335, 2.4472, 7.4771 ]
Cucurbit[7]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[7]uril in aqueous solution at standard conditions? A. bis(dimethylpyridinium)diarylethene (op...
cb7_supplement
base
t2_Cucurbit[7]uril_165
task2
D
N-((5-bromofuran-2-yl)methyl)prop-2-en-1-amine
[ "(2S)-2-((2S)-2-((2S)-2-(2-((3R)-2-amino-3-hydroxybutanamido)acetamido)propanamido)-3-phenylpropanamido)-4-methylpentanamide", "Aluminum trichloride", "Silver chloride", "N-((5-bromofuran-2-yl)methyl)prop-2-en-1-amine" ]
[ 3.7475, 2.9004, 3.54, 6 ]
Cucurbit[7]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[7]uril in aqueous solution at standard conditions? A. (2S)-2-((2S)-2-((2S)-2-(2-((3R)-2-amino...
cb7_supplement
base
t2_Cucurbit[7]uril_166
task2
A
(E)-4-(2-(7-(diethylamino)-2-oxo-2H-chromen-3-yl)vinyl)-1-(3-(trimethylammonio)propyl)pyridin-1-ium bromide
[ "(E)-4-(2-(7-(diethylamino)-2-oxo-2H-chromen-3-yl)vinyl)-1-(3-(trimethylammonio)propyl)pyridin-1-ium bromide", "Phe-Gly-Gly", "1-Adamantylammonium chloride", "Gly-AM Phe-Gly" ]
[ 14.8899, 6.4782, 11.0414, 6.2923 ]
Cucurbit[7]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[7]uril in aqueous solution at standard conditions? A. (E)-4-(2-(7-(diethylamino)-2-oxo-2H-chr...
cb7_supplement
base
t2_Cucurbit[7]uril_167
task2
B
2-Adamantanone
[ "Strontium cation", "2-Adamantanone", "2,7-bis(2-(trimethyl-azaneyl)ethyl)pyrene-1,3,6,8(2H,7H)-tetraone", "Coptisine" ]
[ 3.6435, 10.5911, 4.8681, 8.699 ]
Cucurbit[7]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[7]uril in aqueous solution at standard conditions? A. Strontium cation (SMILES: [Sr+2]). B. 2...
cb7_supplement
base
t2_Cucurbit[7]uril_168
task2
B
Bicyclo[2.2.2]octane-1,4-diyldimethanol
[ "Oxazine 1", "Bicyclo[2.2.2]octane-1,4-diyldimethanol", "Dehydrocorydaline", "1-(3-aminopropyl)-4-4'-bipyridinium" ]
[ 6.2788, 9.7853, 3.3743, 6.6335 ]
Cucurbit[7]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[7]uril in aqueous solution at standard conditions? A. Oxazine 1 (SMILES: CCN(CC)C1=CC2=C(C=C1...
cb7_supplement
base
t2_Cucurbit[7]uril_169
task2
D
1-butyl-3-methylimidazolium hexafluorophosphate
[ "Cesium chloride, Caesium chloride", "Zinc cation", "(Z)‐4‐(4‐(2‐(3′,5′‐bis(trifluoromethyl)‐[1,1′‐biphenyl]‐4‐yl)‐1‐cyanovinyl)phenyl)‐1‐methylpyridin‐1‐ium chloride", "1-butyl-3-methylimidazolium hexafluorophosphate" ]
[ 3.505, 2.3424, 6.0969, 6.8808 ]
Cucurbit[7]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[7]uril in aqueous solution at standard conditions? A. Cesium chloride, Caesium chloride (SMIL...
cb7_supplement
base
t2_Cucurbit[7]uril_170
task2
D
styrylcoumarin
[ "Pinacolone", "((3R)-2-amino-3-hydroxybutanoyl)glycyl-L-alanyl-L-phenylalanyl-L-leucine", "Calcium chloride", "styrylcoumarin" ]
[ 3.8287, 3.4587, 4.1295, 10.0792 ]
Cucurbit[7]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[7]uril in aqueous solution at standard conditions? A. Pinacolone (SMILES: CC(=O)C(C)(C)C). B....
cb7_supplement
base
t2_Cucurbit[7]uril_171
task2
B
1-hexyl-3-methylimidazol-3-ium;bromide
[ "Dopamine hydrochloride", "1-hexyl-3-methylimidazol-3-ium;bromide", "Gly-AM Phe-Gly", "N-((5-chlorofuran-2-yl)methyl)prop-2-en-1-amine" ]
[ 5, 7.2788, 6.2923, 5.6628 ]
Cucurbit[7]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[7]uril in aqueous solution at standard conditions? A. Dopamine hydrochloride (SMILES: C1=CC(=...
cb7_supplement
base
t2_Cucurbit[7]uril_172
task2
B
Pibenzimol HCl
[ "(+)-fenchone", "Pibenzimol HCl", "1,1'-bis(3-aminopropyl)-4,4'-bipyridinium", "cyanine dye LDP" ]
[ 7.4432, 9.1614, 7.0792, 4.7987 ]
Cucurbit[7]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[7]uril in aqueous solution at standard conditions? A. (+)-fenchone (SMILES: CC1(C2CCC(C2)(C1=...
cb7_supplement
base
t2_Cucurbit[7]uril_173
task2
A
pentacyclo[7.3.1.14,12.02,7.06,11]tetradecane-4,9-diol
[ "pentacyclo[7.3.1.14,12.02,7.06,11]tetradecane-4,9-diol", "Dopamine hydrochloride", "Glycyl-phenylalanine", "Pyrrole" ]
[ 7.1335, 5, 3.1139, 3.2304 ]
Cucurbit[7]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[7]uril in aqueous solution at standard conditions? A. pentacyclo[7.3.1.14,12.02,7.06,11]tetra...
cb7_supplement
base
t2_Cucurbit[7]uril_174
task2
A
2-(2-amino-3-phenylpropanamido)-4-(methylthio)butanamide
[ "2-(2-amino-3-phenylpropanamido)-4-(methylthio)butanamide", "6-bromo-1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole", "1,1'-(1,4-phenylenebis(methylene))bis(pyridin-1-ium-4-carboxylate)", "1-(3-aminopropyl)-4-4'-bipyridinium" ]
[ 7.3795, 6.4624, 5.8129, 6.6335 ]
Cucurbit[7]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[7]uril in aqueous solution at standard conditions? A. 2-(2-amino-3-phenylpropanamido)-4-(meth...
cb7_supplement
base
t2_Cucurbit[7]uril_175
task2
A
bis(dimethylpyridinium)diarylethene (open form)
[ "bis(dimethylpyridinium)diarylethene (open form)", "Serotonin", "Vecuronium", "Glycyl-phenylalanine" ]
[ 8.8299, 4.8351, 5.6721, 3.1139 ]
Cucurbit[7]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[7]uril in aqueous solution at standard conditions? A. bis(dimethylpyridinium)diarylethene (op...
cb7_supplement
base
t2_Cucurbit[7]uril_176
task2
D
1-Methyl-4-(pyridin-4-yl)pyridinium
[ "Cesium cation", "Rhodamine methylester chloride", "Glycyl-dl-Tryptophan", "1-Methyl-4-(pyridin-4-yl)pyridinium" ]
[ 2.8388, 3, 2.4472, 6.0792 ]
Cucurbit[7]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[7]uril in aqueous solution at standard conditions? A. Cesium cation (SMILES: [Cs+]). B. Rhoda...
cb7_supplement
base
t2_Cucurbit[7]uril_177
task2
D
H-Phe-Met-OH
[ "Vecuronium", "Dehydrocorydaline", "Octyltrimethylammonium bromide", "H-Phe-Met-OH" ]
[ 5.6721, 3.3743, 6.8062, 7.1461 ]
Cucurbit[7]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[7]uril in aqueous solution at standard conditions? A. Vecuronium (SMILES: CC(=O)OC1CC2CCC3C(C...
cb7_supplement
base
t2_Cucurbit[7]uril_178
task2
A
(E)-4-(2-(7-(diethylamino)-2-oxo-2H-chromen-3-yl)vinyl)-1-(3-(trimethylammonio)propyl)pyridin-1-ium bromide
[ "(E)-4-(2-(7-(diethylamino)-2-oxo-2H-chromen-3-yl)vinyl)-1-(3-(trimethylammonio)propyl)pyridin-1-ium bromide", "4,4'-Bipyridine dihydrochloride", "[Ru(bpy)2dppz]2+", "Thr-Gly-Ala-Phe-Met-NH2" ]
[ 14.8899, 6.5441, 3.4472, 4.3173 ]
Cucurbit[7]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[7]uril in aqueous solution at standard conditions? A. (E)-4-(2-(7-(diethylamino)-2-oxo-2H-chr...
cb7_supplement
base
t2_Cucurbit[7]uril_179
task2
B
1-Adamantanamine
[ "2-Adamantanone", "1-Adamantanamine", "Gly-tyr-gly", "Europium(3+)" ]
[ 10.5911, 12.6232, 3.4314, 3.301 ]
Cucurbit[7]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[7]uril in aqueous solution at standard conditions? A. 2-Adamantanone (SMILES: C1C2CC3CC1CC(C2...
cb7_supplement
base
t2_Cucurbit[7]uril_180
task2
D
((S)-2-amino-3-(4-(aminomethyl)phenyl)propanoyl)-L-methionine
[ "Acridine Yellow G", "Cesium chloride, Caesium chloride", "bis(dimethylpyridinium)diarylethene (closed form)", "((S)-2-amino-3-(4-(aminomethyl)phenyl)propanoyl)-L-methionine" ]
[ 4.4364, 3.505, 7.8451, 8.7243 ]
Cucurbit[7]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[7]uril in aqueous solution at standard conditions? A. Acridine Yellow G (SMILES: CC1=CC2=CC3=...
cb7_supplement
base
t2_Cucurbit[7]uril_181
task2
A
Hexyltrimethylammonium bromide
[ "Hexyltrimethylammonium bromide", "AntNMe2+-2kPEG-OMe", "Rhodamine 6G", "[C3mim]Br" ]
[ 6.7404, 3.9031, 4.699, 6.2788 ]
Cucurbit[7]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[7]uril in aqueous solution at standard conditions? A. Hexyltrimethylammonium bromide (SMILES:...
cb7_supplement
base
t2_Cucurbit[7]uril_182
task2
D
1-benzyl-3-methylimidazol-3-ium bromide
[ "(2-(2-(2-(2-(4-(pyridine-2-yl)-1H-1,2,3-triazole-1-yl)ethoxy)ethoxy)ethoxy)ethan-1-ol)", "1-Butanol", "cyanine dye LDP", "1-benzyl-3-methylimidazol-3-ium bromide" ]
[ 4.2504, 4.79, 4.7987, 5.9031 ]
Cucurbit[7]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[7]uril in aqueous solution at standard conditions? A. (2-(2-(2-(2-(4-(pyridine-2-yl)-1H-1,2,3...
cb7_supplement
base
t2_Cucurbit[7]uril_183
task2
A
Cadaverine (fully protonated form)
[ "Cadaverine (fully protonated form)", "Oxazine 1", "Gadolinium(3+)", "Serotonin" ]
[ 7.1461, 6.2788, 2.9294, 4.8351 ]
Cucurbit[7]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[7]uril in aqueous solution at standard conditions? A. Cadaverine (fully protonated form) (SMI...
cb7_supplement
base
t2_Cucurbit[7]uril_184
task2
A
2-(2-amino-3-phenylpropanamido)-4-(methylthio)butanamide
[ "2-(2-amino-3-phenylpropanamido)-4-(methylthio)butanamide", "1-methyl-3-[[4-[4-[(3-methylimidazol-3-ium-1-yl)methyl]phenyl]phenyl]methyl]imidazol-1-ium", "Nickel chloride", "4-(dimethylamino)benzonitrile" ]
[ 7.3795, 5.2742, 3.5, 5.4024 ]
Cucurbit[7]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[7]uril in aqueous solution at standard conditions? A. 2-(2-amino-3-phenylpropanamido)-4-(meth...
cb7_supplement
base
t2_Cucurbit[7]uril_185
task2
C
p-xylylenediamine dihydrochloride
[ "Hexamethylenediamine", "(2S)-2-amino-3-phenylpropanoic acidhydrochloride", "p-xylylenediamine dihydrochloride", "1,1'-bis(3,5-diethoxybenzyl)-[4,4'-bipyridine]-1,1'-diium" ]
[ 9.3222, 5.6021, 9.5185, 5.9031 ]
Cucurbit[7]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[7]uril in aqueous solution at standard conditions? A. Hexamethylenediamine (SMILES: C(CCCN)CC...
cb7_supplement
base
t2_Cucurbit[7]uril_186
task2
C
1,1'-bis(3,5-diethoxybenzyl)-[4,4'-bipyridine]-1,1'-diium
[ "Iron(III) chloride", "4-(diethylamino)benzonitrile", "1,1'-bis(3,5-diethoxybenzyl)-[4,4'-bipyridine]-1,1'-diium", "Prednisolone" ]
[ 4.179, 5.2732, 5.9031, 3 ]
Cucurbit[7]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[7]uril in aqueous solution at standard conditions? A. Iron(III) chloride (SMILES: Cl[Fe](Cl)C...
cb7_supplement
base
t2_Cucurbit[7]uril_187
task2
C
bis(dimethylpyridinium)diarylethene (open form)
[ "Nitric acid", "1-methyl-3-[[4-[(3-methylimidazol-3-ium-1-yl)methyl]phenyl]methyl]imidazol-1-ium", "bis(dimethylpyridinium)diarylethene (open form)", "Dehydrocorydaline" ]
[ 1.9443, 6.42, 8.8299, 3.3743 ]
Cucurbit[7]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[7]uril in aqueous solution at standard conditions? A. Nitric acid (SMILES: [N+](=O)(O)[O-]). ...
cb7_supplement
base
t2_Cucurbit[7]uril_188
task2
C
AM Phe-Gly-Gly
[ "Tryptophyl-Glycine", "6-Phenylamino-naphthalene-2-sulfonic acid anion", "AM Phe-Gly-Gly", "1,2,3,6,7,7a-hexahydro-3a,6-epoxyisoindole" ]
[ 5.7482, 2.7782, 9.0212, 6.7993 ]
Cucurbit[7]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[7]uril in aqueous solution at standard conditions? A. Tryptophyl-Glycine (SMILES: C1=CC=C2C(=...
cb7_supplement
base
t2_Cucurbit[7]uril_189
task2
C
Gly-AM Phe-Gly
[ "Prednisolone", "N,N-dimethylformamide", "Gly-AM Phe-Gly", "Lithium chloride" ]
[ 3, 2.8926, 6.2923, 2.3404 ]
Cucurbit[7]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[7]uril in aqueous solution at standard conditions? A. Prednisolone (SMILES: CC12CC(C3C(C1CCC2...
cb7_supplement
base
t2_Cucurbit[7]uril_190
task2
D
(E)-4-(2-(7-(diethylamino)-2-oxo-2H-chromen-3-yl)vinyl)-1-(3-(trimethylammonio)propyl)pyridin-1-ium bromide
[ "Serotonin", "H-phe-leu-oh", "1-butyl-3-methylimidazol-3-ium;tetrafluoroborate", "(E)-4-(2-(7-(diethylamino)-2-oxo-2H-chromen-3-yl)vinyl)-1-(3-(trimethylammonio)propyl)pyridin-1-ium bromide" ]
[ 4.8351, 6.5256, 6.8808, 14.8899 ]
Cucurbit[7]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[7]uril in aqueous solution at standard conditions? A. Serotonin (SMILES: C1=CC2=C(C=C1O)C(=CN...
cb7_supplement
base
t2_Cucurbit[7]uril_191
task2
C
bis(Trimethylamminomethyl)ferrocene
[ "Pinacolone", "Phe-Gly-Gly", "bis(Trimethylamminomethyl)ferrocene", "Tryptophyl-Glycine" ]
[ 3.8287, 6.4782, 15.5002, 5.7482 ]
Cucurbit[7]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[7]uril in aqueous solution at standard conditions? A. Pinacolone (SMILES: CC(=O)C(C)(C)C). B....
cb7_supplement
base
t2_Cucurbit[7]uril_192
task2
D
1H-​Imidazolium, 3-​butyl-​1-​methyl-​, bromide
[ "1,1'-(1,4-phenylenebis(methylene))bis(pyridin-1-ium-4-carboxylate)", "Decyltrimethylammonium bromide", "Cesium chloride, Caesium chloride", "1H-​Imidazolium, 3-​butyl-​1-​methyl-​, bromide" ]
[ 5.8129, 6.5085, 3.505, 6.7993 ]
Cucurbit[7]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[7]uril in aqueous solution at standard conditions? A. 1,1'-(1,4-phenylenebis(methylene))bis(p...
cb7_supplement
base
t2_Cucurbit[7]uril_193
task2
C
Epiberberine
[ "11-aminoundecanoic acid", "1-butyl-3-methylimidazolium hexafluorophosphate", "Epiberberine", "pentane-1,5-diamine dihydrochloride" ]
[ 2.69, 6.8808, 8.7924, 8.1461 ]
Cucurbit[7]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[7]uril in aqueous solution at standard conditions? A. 11-aminoundecanoic acid (SMILES: C(CCCC...
cb7_supplement
base
t2_Cucurbit[7]uril_194
task2
B
(+)-fenchone
[ "Geranylamine", "(+)-fenchone", "Magnesium chloride", "L-Tyrosine" ]
[ 6.2788, 7.4432, 3.24, 4.2041 ]
Cucurbit[7]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[7]uril in aqueous solution at standard conditions? A. Geranylamine (SMILES: CC(=CCCC(=CCN)C)C...
cb7_supplement
base
t2_Cucurbit[7]uril_195
task2
C
Cholesterol
[ "1-Phenyl-2-butanone", "Cesium chloride, Caesium chloride", "Cholesterol", "Tryptophyl-Glycine" ]
[ 3.6628, 3.505, 5.9101, 5.7482 ]
Cucurbit[7]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[7]uril in aqueous solution at standard conditions? A. 1-Phenyl-2-butanone (SMILES: CCC(=O)Cc1...
cb7_supplement
base
t2_Cucurbit[7]uril_196
task2
B
((Dimethylamino)methyl)ferrocene
[ "Thr-Gly-Ser-Phe-Met-NH2", "((Dimethylamino)methyl)ferrocene", "Borneol", "2,3-Diazabicyclo(2.2.2)oct-2-ene" ]
[ 4.4822, 12.3406, 8.415, 7.1271 ]
Cucurbit[7]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[7]uril in aqueous solution at standard conditions? A. Thr-Gly-Ser-Phe-Met-NH2 (SMILES: CSCC[C...
cb7_supplement
base
t2_Cucurbit[7]uril_197
task2
C
1-Adamantanol
[ "AM Phe", "Acetophenone", "1-Adamantanol", "4-(diethylamino)benzonitrile" ]
[ 6.3365, 3.9823, 10.3944, 5.2732 ]
Cucurbit[7]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[7]uril in aqueous solution at standard conditions? A. AM Phe (SMILES: C1=CC(=CC=C1CC(C(=O)O)N...
cb7_supplement
base
t2_Cucurbit[7]uril_198
task2
A
Proflavine
[ "Proflavine", "Acridine Orange hydrochloride (protonated)", "11-aminoundecanoic acid", "Trp-met-gly" ]
[ 7.301, 5.301, 2.69, 5.3617 ]
Cucurbit[7]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[7]uril in aqueous solution at standard conditions? A. Proflavine (SMILES: C1=CC(=CC2=NC3=C(C=...
cb7_supplement
base
t2_Cucurbit[7]uril_199
task2
A
pentacyclo[7.3.1.14,12.02,7.06,11]tetradecane-4,9-diol
[ "pentacyclo[7.3.1.14,12.02,7.06,11]tetradecane-4,9-diol", "Rhodamine methylester chloride", "Eucalyptol", "tyrosylmethionine" ]
[ 7.1335, 3, 5.9294, 5.8062 ]
Cucurbit[7]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[7]uril in aqueous solution at standard conditions? A. pentacyclo[7.3.1.14,12.02,7.06,11]tetra...
cb7_supplement
base