0 B15R1.4038 COC1=C(C=CC(=C1)CC(N)C(=O)O)O Z3212891663 [1,0,0,0,0,0|1,0,0]=2 1 B15R1.11316 CC1=C(C=CC(=C1)CC(C)(C)C(=O)O)Br Z2165882431 [1,0,0,0,0,0|2,0,0]=3 2 B15R1.11316 C[C@@](N)(CC1=CC(=C(C=C1)O)O)C(=O)O Z1508927176 [1,0,0,0,0,0|1,0,0]=2 3 B15R1.11316 C[C@](N)(CC1=CC(=C(C=C1)O)O)C(=O)O Z1508915075 [1,0,0,0,0,0|1,0,0]=2 4 B15R1.4049 COC1=C(C=CC(=C1)C(C)(C)C(=O)O)N Z1509544673 [0,0,0,0,1,0|2,0,0]=3 5 B14R1.42 COC1=C(C=CC(=C1)/C=C/C(=O)O)O Z56782558 [2,0,0,0,0,0|0,0,2]=4 6 B14R1.42 COC1=C(C=CC(=C1)CCC(=O)C)O Z1255442373 [2,0,0,0,0,0|1,0,0]=3 7 B14R1.42 COC1=C(C=CC(=C1)CCC(=O)O)Cl Z1269146778 [2,0,0,0,0,0|1,0,0]=3 8 B14R1.42 COC1=C(C=CC(=C1)CCC(=O)O)O Z317038020 [2,0,0,0,0,0|0,0,0]=2 9 B14R1.42 O=CC1=C(C=CC(=C1)CCC(=O)O)O Z1262519251 [2,0,0,0,0,0|2,0,0]=4 10 B14R1.75 COC1=CC(=CC=C1)/C=C(\C)/C(=O)O Z57229610 [2,0,0,0,0,0|0,0,2]=4 11 B14R1.75 COC1=CC(=CC=C1)CC(=O)C(=O)O Z271004522 [2,0,0,0,0,0|0,0,2]=4 12 B14R1.75 COC1=CC(=CC=C1)CC(N)C(=O)O Z317024998 [2,0,0,0,0,0|1,0,0]=3 13 B14R1.75 COC1=CC(=CC=C1)CC(O)C(=O)O Z1255373702 [2,0,0,0,0,0|0,0,0]=2 14 B14R1.686 CC(CC1=CC(=C(C=C1)F)Br)C(=O)O Z756390562 [2,0,0,0,0,0|2,0,0]=4 15 B14R1.686 CC(CC1=CC(=C(C=C1)F)F)C(=O)O Z1341747667 [2,0,0,0,0,0|2,0,0]=4 16 B14R1.686 CC(CC1=CC(=C(C=C1)O)O)C(=O)O Z1198162859 [2,0,0,0,0,0|0,0,0]=2 17 B14R1.686 CC1=C(C=C(C=C1)CC(N)C(=O)O)C Z2238618571 [2,0,0,0,0,0|2,0,0]=4 18 B14R1.686 CC1=C(C=C(C=C1)CC(S)C(=O)O)C Z57982188 [2,0,0,0,0,0|1,1,0]=4 19 B14R1.686 CC1=C(C=CC(=C1)OC(C)C(=O)O)Cl Z149187304 [2,0,0,0,0,0|2,0,0]=4 20 B14R1.686 N[C@@H](CC1=CC(=C(C=C1)O)Br)C(=O)O Z1269188313 [2,0,0,0,0,0|2,0,0]=4 21 B14R1.686 N[C@@H](CC1=CC(=C(C=C1)O)I)C(=O)O Z1269198907 [2,0,0,0,0,0|2,0,0]=4 22 B14R1.686 N[C@@H](CC1=CC(=C(C=C1)O)O)C(=O)O Z756440064 [2,0,0,0,0,0|1,0,0]=3 23 B14R1.686 N[C@H](CC1=CC(=C(C=C1)O)O)C(=O)O Z1255419382 [2,0,0,0,0,0|1,0,0]=3 24 B14R1.4404 CC(C)(CC1=CC(=CC=C1)Cl)C(=O)O Z995179628 [2,0,0,0,0,0|2,0,0]=4 25 B14R1.7626 CC(C)(CC1=CC=C(C=C1)Br)C(=O)O Z995179700 [2,0,0,0,0,0|2,0,0]=4 26 B14R1.7626 CC(C)(CC1=CC=C(C=C1)Cl)C(=O)O Z995179626 [2,0,0,0,0,0|2,0,0]=4 27 B14R1.7626 CC(C)(CC1=CC=C(C=C1)O)C(=O)O Z1376887330 [2,0,0,0,0,0|1,0,0]=3 28 B14R1.7626 CC(N)(CC1=CC=C(C=C1)Br)C(=O)O Z2786605576 [2,0,0,0,0,0|2,0,0]=4 29 B14R1.7626 CC(N)(CC1=CC=C(C=C1)F)C(=O)O Z2734797269 [2,0,0,0,0,0|2,0,0]=4 30 B14R1.7626 C[C@](N)(CC1=CC=C(C=C1)O)C(=O)O Z1255434943 [2,0,0,0,0,0|1,0,0]=3 31 B16R1.4274 COC1=C(C=C(C=C1)CC(C)C(=O)O)OC Z1233159921 [1,1,0,0,0,0|0,0,0]=2 32 B16R1.4730 COC(=O)C(N)CC1=CC(=C(C=C1)O)OC Z3221821579 [1,1,0,0,0,0|1,0,0]=3 33 B16R1.94545 C[C@@](CC1=CC(=C(C=C1)O)O)(NN)C(=O)O Z2301684895 [1,1,0,0,0,0|1,0,0]=3 34 B16R1.25087 COC1=C(C=C(C=C1)CC(C)(N)CO)OC Z2753800585 [1,1,0,0,0,0|1,0,1]=4 35 B16R1.25087 COC1=C(C=C(C=C1)CC(C)(O)CN)OC Z2168499544 [1,1,0,0,0,0|1,0,1]=4 36 B16R1.4751 COC(=O)C(C)(C)C1=CC(=C(C=C1)N)OC Z5414179555 [0,1,0,0,1,0|2,0,0]=4 37 B16R1.25085 COC1=C(C=C(C=C1)C(C)(C)C(=O)O)OC Z725146384 [0,1,0,0,1,0|1,0,0]=3 38 B16R1.25085 COC1=C(C=C(C=C1)C(C)(N)C(=O)O)OC Z317024952 [0,1,0,0,1,0|1,0,0]=3 39 B18R1.368760 CCC(C)(CC1=CC(=C(C=C1)OC)OC)C(=O)O Z1321947530 [0,2,0,0,0,0|1,0,0]=3 40 B18R1.368760 COC1=C(C=C(C=C1)CC(C)(CN)C(=O)O)OC Z4496117333 [0,2,0,0,0,0|1,0,0]=3 41 B16R2.6257 NC(CC1=CC2=C(C=C1)OCO2)C(=O)O Z381429884 [1,0,0,1,0,0|1,0,0]=3 42 B16R2.33227 CC1=C(C=CC(=C1)CC2(CC2)C(=O)O)F Z3217467316 [1,0,0,1,0,0|2,0,0]=4 43 B16R2.27234 CC(C)(C(=O)O)C1=CC2=C(C=C1)OCO2 Z725146422 [0,0,0,1,1,0|1,0,0]=3 44 B16R2.54858 COC1=C(C=CC(=C1)C2(CC2)C(=O)O)C Z361883692 [0,0,0,1,1,0|2,0,0]=4 45 B18R2.146678 COC1=C(C=C(C=C1)C2NC(=O)C2(C)C)OC Z2158392093 [0,1,0,1,0,0|2,0,0]=4 46 B18R2.146694 COC1=C(C=C(C=C1)CC2(CC2)C(=O)O)OC Z1321950958 [0,1,0,1,0,0|1,0,0]=3 47 B18R2.844806 COC1=C(C=C2CC(CC2=C1)(C)C(=O)O)OC Z4918744495 [0,1,0,1,0,0|1,0,0]=3 48 B14R1.3583 COC1=CC(=CC=C1)C(C)(C)C(=O)O Z801751988 [1,0,0,0,1,0|1,0,0]=3 49 B14R1.3583 COC1=CC(=CC=C1)C(F)(F)C(=O)O Z335859738 [1,0,0,0,1,0|2,0,0]=4 50 B14R1.699 CC(O)(C(=O)O)C1=CC(=C(C=C1)F)Br Z1037543498 [1,0,0,0,1,0|2,0,0]=4 51 B14R1.699 CC1=C(C=CC(=C1)C(C)(C)C(=O)O)Br Z1269228277 [1,0,0,0,1,0|2,0,0]=4 52 B14R1.699 CC1=C(C=CC(=C1)C(C)(C)C(=O)O)F Z982130548 [1,0,0,0,1,0|2,0,0]=4 53 B16R1.5390 COC1=CC(=CC=C1)CC(C)(C)CC(=O)O Z1434172054 [1,0,0,0,0,1|1,0,0]=3 54 B16R1.86971 COC1=NC=NC(=C1)NCC(C)(O)C(=O)O Z2466039758 [1,0,0,0,0,1|2,0,0]=4