1 PHB P-hydroxybenzoic acid 1.000 2 A1LXW 3-methyl-4-oxidanyl-benzoic acid 0.909 3 CHB 3-chloro-4-hydroxybenzoic acid 0.909 4 DHB 3,4-dihydroxybenzoic acid 0.909 5 DOB 2,4-dihydroxybenzoic acid 0.909 6 FHB 3-fluoro-4-hydroxybenzoic acid 0.909 7 IHB 3-iodo-4-hydroxybenzoic acid 0.909 8 QSB 3 bromo 4 hydroxybenzoic acid 0.909 9 BEZ Benzoic acid 0.900 10 HB0 Trans-4-(hydroxymethyl)cyclohexanol 0.900 11 HBA P-hydroxybenzaldehyde 0.900 12 RXK Cyclohexanecarboxylic acid 0.900 13 3DS (4s,5r)-4,5-dihydroxy-3-oxocyclohex-1-ene-1-carboxylic acid 0.833 14 6X7 2,4-dihydroxy-6-methyl benzoic acid 0.833 15 DHK 3-dehydroshikimate 0.833 16 DHS 3-amino-4,5-dihydroxy-cyclohex-1-enecarboxylate 0.833 17 FA1 2,3 -anhydro-quinic acid 0.833 18 FGZ 3,5-dichloro-4-hydroxybenzoic acid 0.833 19 FQZ (1~{R},3~{S},4~{R},5~{R})-3-methyl-4,5-bis(hydroxyl)cyclohexane-1-carboxylic acid 0.833 20 FT5 (3~{R})-3,4,5-tris(hydroxyl)cyclohexane-1-carboxylic acid 0.833 21 GDE 3,4,5-trihydroxybenzoic acid 0.833 22 PVI (4r,5r)-3-amino-4,5-dihydroxy-cyclohexene-1-carboxylic acid 0.833 23 QSH 3,5-bis(bromanyl)-4-oxidanyl-benzoic acid 0.833 24 SKM (3r,4s,5r)-3,4,5-trihydroxycyclohex-1-ene-1-carboxylic acid 0.833 25 VNL 4-hydroxy-3-methoxybenzoate 0.833 26 02K 1-aminocyclohexanecarboxylic acid 0.818 27 174 4-chloro-benzoic acid 0.818 28 1Y6 4-fluorobenzoic acid 0.818 29 3BZ 3-chlorobenzoate 0.818 30 3HB 3-hydroxybenzoic acid 0.818 31 3OC (1r)-3-oxocyclohexanecarboxylic acid 0.818 32 3SK 2-methylbenzoic acid 0.818 33 3U4 2-fluorobenzoic acid 0.818 34 4MA 4-methylbenzoic acid 0.818 35 6RK 4-azanylcyclohexane-1-carboxylic acid 0.818 36 7WV 2-bromobenzoic acid 0.818 37 8EZ (1~{R},2~{S})-2-methylcyclohexane-1-carboxylic acid 0.818 38 A1IBT 2-selanylbenzoic acid 0.818 39 AC6 P-hydroxyacetophenone 0.818 40 BE2 2-aminobenzoic acid 0.818 41 E6F (1~{S},2~{S})-2-azanylcyclohexane-1-carboxylic acid 0.818 42 GAB 3-aminobenzoic acid 0.818 43 GBC Gabaculine 0.818 44 H6N Protocatechuic aldehyde 0.818 45 HBD 4-hydroxybenzamide 0.818 46 JKE 2-sulfanylbenzoic acid 0.818 47 KZ6 4-iodobenzoic acid 0.818 48 MBO Mercuribenzoic acid 0.818 49 O78 (3z)-3-iminocyclohex-1-ene-1-carboxylic acid 0.818 50 OA7 6-hydroxypyridine-3-carboxylic acid 0.818 51 OVV 3-methylbenzoic acid 0.818 52 PAB 4-aminobenzoic acid 0.818 53 QRM 3-aminocyclohexa-1,3-diene-1-carboxylic acid 0.818 54 SAL 2-hydroxybenzoic acid 0.818 55 VDK [(1s,3s)-3-carboxycyclohexyl]azanium 0.818 56 Z82 4-bromobenzoic acid 0.818 57 010 Phenylmethanol 0.800 58 HBX Benzaldehyde 0.800 59 PCR P-cresol 0.800 60 7WR 3-methoxy-4,5-bis(oxidanyl)benzoic acid 0.769 61 DQA 1,3,4-trihydroxy-5-oxo-cyclohexanecarboxylic acid 0.769 62 FA3 2-anhydro-3-fluoro-quinic acid 0.769 63 FSQ (1~{S},3~{R},4~{S},5~{R})-3-methyl-3,4,5-tris(hydroxyl)cyclohexane-1-carboxylic acid 0.769 64 GJS 4-hydroxybenzene-1,2-dicarboxylic acid 0.769 65 H62 (1~{R},2~{R},3~{R},4~{S},6~{S})-6-azanyl-2,3,4-tris(oxidanyl)cyclohexane-1-carboxylic acid 0.769 66 OVU (1~{S},2~{R},4~{R},5~{S},6~{S})-2,4,5-trihydroxy-7-oxabicyclo[4.1.0]heptane-2-carboxylic acid 0.769 67 QIC (1s,3r,4s,5r)-1,3,4,5-tetrahydroxycyclohexanecarboxylic acid 0.769 68 WPL (1~{S},3~{S},4~{R},5~{R})-3-methyl-1,4,5-tris(hydroxyl)cyclohexane-1-carboxylic acid 0.769 69 1CW 3-amino-2-hydroxybenzoic acid 0.750 70 34D 3,5-dihydroxybenzoate 0.750 71 34Z 3,4-dichlorobenzoate 0.750 72 3AZ 3-(aminomethyl)benzoic acid 0.750 73 3F0 2-azanyl-3-fluoranyl-benzoic acid 0.750 74 3HA 3-hydroxyanthranilic acid 0.750 75 3M0 2-azanyl-3-methyl-benzoic acid 0.750 76 4A3 4-amino-3-hydroxybenzoic acid 0.750 77 4AY 4-(bromomethyl)benzoic acid 0.750 78 4AZ 4-(aminomethyl)benzoic acid 0.750 79 4M0 2-azanyl-4-methyl-benzoic acid 0.750 80 4MI 4-methylsulfanylbenzoic acid 0.750 81 54G 2-hydroxy-5-methylbenzoic acid 0.750 82 5M0 2-azanyl-5-methyl-benzoic acid 0.750 83 5RG 2-amino-5-fluorobenzoic acid 0.750 84 6F0 2-azanyl-6-fluoranyl-benzoic acid 0.750 85 6M1 2-amino-6-methylbenzoic acid 0.750 86 71F 2-methoxybenzoic acid 0.750 87 81P 4-(methylamino)benzoic acid 0.750 88 9TZ 5-fluoranyl-2-methyl-benzoic acid 0.750 89 A1BUB 2-hydroxy-4-methylbenzoic acid 0.750 90 A1D71 3-chloranyl-5-oxidanyl-benzoic acid 0.750 91 ADH 1-amino-2,3-dihydroxy-5-hydroxymethyl cyclohex-5-ene 0.750 92 AMH Trans-4-aminomethylcyclohexane-1-carboxylic acid 0.750 93 ANN 4-methoxybenzoic acid 0.750 94 AUU (1s,2s,4r)-2-aminobicyclo[2.2.1]heptane-2-carboxylic acid 0.750 95 AW5 3-methyl-5-oxidanyl-benzoic acid 0.750 96 BE7 (4-carboxyphenyl)(chloro)mercury 0.750 97 BHA 2-hydroxy-4-aminobenzoic acid 0.750 98 D0U 4-azanyl-2-sulfanyl-benzoic acid 0.750 99 DBH 2,3-dihydroxy-benzoic acid 0.750 100 DHR (2s)-hydroxy(4-hydroxyphenyl)ethanenitrile 0.750 101 E5X 4-(hydroxymethyl)benzoic acid 0.750 102 EGM 4-ethylbenzoic acid 0.750 103 FA0 2-amino-4-fluorobenzoic acid 0.750 104 GRE 2,6-dihydroxybenzoic acid 0.750 105 GTQ 2,5-dihydroxybenzoic acid 0.750 106 HDH 4-oxidanylbenzohydrazide 0.750 107 HFO 1-[3,4-bis(oxidanyl)phenyl]ethanone 0.750 108 HGB 4-(hydroxymercury)benzoic acid 0.750 109 HHA (2s,3s)-trans-2,3-dihydro-3-hydroxyanthranilic acid 0.750 110 IT4 4-bromanyl-2-oxidanyl-benzoic acid 0.750 111 L3C 4-(chloromethyl)benzoic acid 0.750 112 MPB 4-hydroxy-benzoic acid methyl ester 0.750 113 MW7 4-ethenylbenzoic acid 0.750 114 NLZ 2,4-bis(oxidanyl)benzamide 0.750 115 NNO 6-hydroxyisonicotinic acid N-oxide 0.750 116 OOI 4-fluorosalicyclic acid 0.750 117 OTR 4-(2r-amino-1-hydroxyethyl)phenol 0.750 118 OTS 4-(2s-amino-1-hydroxyethyl)phenol 0.750 119 OVM 3-methoxybenzoic acid 0.750 120 OVP 3-(methylsulfanyl)benzoic acid 0.750 121 OW4 3-(methylamino)benzoic acid 0.750 122 PF0 3-hydroxy-2-methylbenzoic acid 0.750 123 SX1 2-amino-5-bromobenzoic acid 0.750 124 V55 4-hydroxy-3-methoxybenzaldehyde 0.750 125 VU0 (1~{S},2~{R},4~{R})-2-azanylbicyclo[2.2.1]heptane-2-carboxylic acid 0.750 126 YTP 1-(4-hydroxy-3-methylphenyl)ethanone 0.750 127 2AC 2-amino-P-cresol 0.727 128 2MP 3,4-dimethylphenol 0.727 129 3HY 3-(hydroxymethyl)phenol 0.727 130 4HR (2-bromophenyl)methanol 0.727 131 4JL (4-chlorophenyl)methanol 0.727 132 4VP 4-ethenylphenol 0.727 133 6PC Pyridine-2-carboxylic acid 0.727 134 7YO (2r)-5-oxidanylidenepyrrolidine-2-carboxylic acid 0.727 135 A1BDB (3s)-piperidine-3-carboxylic acid 0.727 136 AC0 1-phenylethanone 0.727 137 B74 (3-methylphenyl)methanol 0.727 138 BRB Para-bromobenzyl alcohol 0.727 139 CPI 6-carboxypiperidine 0.727 140 E7I Benzoselenoate 0.727 141 ETY 4-ethylphenol 0.727 142 GJM (2s)-oxane-2-carboxylic acid 0.727 143 H8N 4-hydroxybenzonitrile 0.727 144 HT4 4-methyl-2-sulfanylphenol 0.727 145 ID7 (3r)-piperidine-3-carboxylic acid 0.727 146 IOB 3-iodo-benzyl alcohol 0.727 147 MCT 4-methylcatechol 0.727 148 MN1 4-carboxypiperidine 0.727 149 N0D 2,4-dimethylphenol 0.727 150 NIO Nicotinic acid 0.727 151 NK Salicylaldehyde 0.727 152 PCA Pyroglutamic acid 0.727 153 S3V Pyridine-4-carboxylic acid 0.727 154 SA9 2-(hydroxymethyl)phenol 0.727 155 SOA Isatoic anhydride 0.727 156 SS1 1-phenylethanol 0.727 157 SS2 (1r)-1-phenylethanol 0.727 158 UNU Benzamide 0.727 159 VTG (4-methylphenyl)methanol 0.727 160 WM2 Cyclohexanecarboxamide 0.727 161 XRE 5-hydroxyproline 0.727 162 YCP (2s)-piperidine-2-carboxylic acid 0.727 163 ZK2 (2-methylphenyl)methanol 0.727 164 48P (1r,4r,5r)-1,4,5-trihydroxy-3-hydroxymethylcyclohex-2-ene-1-carboxylic acid 0.714 165 8I4 (2r,3s,5r,6r)-2,3,4,5,6-pentakis(oxidanyl)cyclohexane-1-carboxylic acid 0.714 166 8XQ 8-hydroxyquinoline-5-carboxylic acid 0.714 167 9C4 (2s)-2-hydroxy-3-epiquinic acid 0.714 168 9PY (2r)-2-methyl-3-dehydroquinic acid 0.714 169 FA6 3-hydroxyimino quinic acid 0.714 170 H6B (1~{R},2~{R},3~{R},4~{S},5~{S},6~{R})-7-methyl-3,4,5-tris(oxidanyl)-7-azabicyclo[4.1.0]heptane-2-carboxylic acid 0.714 171 IJP 3,5-dimethoxy-4-oxidanyl-benzoic acid 0.714 172 L9D (1s,2r,3s,4s,5s,6r)-2-amino-3,4,5,6-tetrahydroxycyclohexane-1-carboxylic acid 0.714 173 L9Z (1~{S},3~{S},4~{S},5~{R})-3-(aminomethyl)-3,4,5-tris(hydroxyl)cyclohexane-1-carboxylic acid 0.714 174 VAU (1~{R},3~{R},4~{S},5~{R})-3-methyl-1,3,4,5-tetrakis(oxidanyl)cyclohexane-1-carboxylic acid 0.714 175 A1ADL 1-methylcyclohex-1-ene 0.700 176 A2Q Cyclohex-2-en-1-one 0.700 177 CXL Cyclohexanol 0.700 178 CYH Cyclohexanone 0.700 179 IPH Phenol 0.700 180 MBN Toluene 0.700 181 QTE Methylcyclohexane 0.700