0 B15R1.12250 CC(=O)C(C)C1=CC=C(C=C1)CC(C)C Z1276728173 [0,0,0,0,0,0|1,0,0]=1 1 B15R1.12250 CC(C)CC1=CC=C(C=C1)C(C)C(=O)O Z1695709473 [0,0,0,0,0,0|0,0,0]=0 2 B15R1.12250 CC(C)CC1=CC=C(C=C1)C(N)C(C)C Z94598489 [0,0,0,0,0,0|3,0,1]=4 3 B15R1.12250 CC(C)CC1=CC=C(C=C1)[C@H](C)C(=O)O Z1508914616 [0,0,0,0,0,0|0,0,0]=0 4 B15R1.12250 CC(C)OC1=CC=C(C=C1)C(N)C(C)O Z4927289808 [0,0,0,0,0,0|3,0,1]=4 5 B14R1.717 CC(C)CC1=CC=C(C=C1)C(C)C=O Z3227040728 [1,0,0,0,0,0|0,0,0]=1 6 B14R1.805 CC(=O)NC1=CC=C(C=C1)CC(=O)O Z90122510 [1,0,0,0,0,0|2,0,1]=4 7 B14R1.805 CC(=O)OC1=CC=C(C=C1)CC(=O)O Z1255442303 [1,0,0,0,0,0|2,0,1]=4 8 B14R1.805 CC(C)CC1=CC=C(C=C1)CC(=O)O Z94602147 [1,0,0,0,0,0|0,0,0]=1 9 B14R1.805 CC(C)OC1=CC=C(C=C1)CC(=O)O Z227753968 [1,0,0,0,0,0|1,0,0]=2 10 B14R1.805 O=C(O)CC1=CC=C(C=C1)OC(F)F Z90123309 [1,0,0,0,0,0|3,0,0]=4 11 B16R1.1636 COC(=O)N(C)C1=CC=C(C=C1)OC(C)C Z1425802759 [0,1,0,0,0,0|2,0,0]=3 12 B16R1.2914 CC(CO)CC1=CC=C(C=C1)C(C)C(=O)O Z2049740133 [0,1,0,0,0,0|0,0,0]=1 13 B16R1.4124 CC(C(=O)O)C1=CC=C(C=C1)CC(C)(C)O Z2049705411 [0,1,0,0,0,0|0,0,0]=1 14 B16R1.18085 CC(C)CC1=CC=C(C=C1)C(C)(N)C(=O)O Z234896481 [0,1,0,0,0,0|0,0,0]=1 15 B16R1.24540 CC(C)C(=O)C1=CC=C(C=C1)C(C)C(=O)O Z1946040605 [0,1,0,0,0,0|0,0,1]=2 16 B14R1.6402 CC(C(=O)O)C1=CC=C(C=C1)N(C)C Z792363902 [0,0,0,0,1,0|1,0,0]=2 17 B16R1.1282 CC(=O)NC(C)C1=CC=C(C=C1)SC(C)C Z1118786529 [0,0,0,0,0,1|2,0,0]=3 18 B16R1.1283 CC(=O)NC1=CC=C(C=C1)SC(C)C(=O)O Z56279652 [0,0,0,0,0,1|2,0,1]=4 19 B16R1.1283 CC(C)OC1=CC=C(C=C1)CC(N)C(=O)O Z4297902662 [0,0,0,0,0,1|2,0,0]=3 20 B13R1.36 CC(C(=O)O)C1=CC=C(C=C1)C=O Z1198177006 [2,0,0,0,0,0|1,0,1]=4 21 B13R1.36 CCC1=CC=C(C=C1)C(C)C(=O)O Z792377226 [2,0,0,0,0,0|0,0,0]=2 22 B13R1.36 CCC1=CC=C(C=C1)C(N)C(=O)O Z317024600 [2,0,0,0,0,0|1,0,0]=3 23 B13R1.36 COC1=CC=C(C=C1)C(C)C(=O)C Z1276728136 [2,0,0,0,0,0|2,0,0]=4 24 B13R1.36 COC1=CC=C(C=C1)C(C)C(=O)O Z792377298 [2,0,0,0,0,0|1,0,0]=3 25 B13R1.36 COC1=CC=C(C=C1)C(N)C(=O)O Z56755722 [2,0,0,0,0,0|2,0,0]=4 26 B13R1.36 NC(C(=O)O)C1=CC=C(C=C1)CO Z2510296391 [2,0,0,0,0,0|2,0,0]=4 27 B13R1.139 CCCC1=CC=C(C=C1)C(C)C=O Z1255496229 [2,0,0,0,0,0|0,0,0]=2 28 B13R1.139 CCOC1=CC=C(C=C1)C(C)C=O Z1255425331 [2,0,0,0,0,0|1,0,0]=3 29 B13R1.142 CC(C)CC1=CC=C(C=C1)CCN Z3506600787 [2,0,0,0,0,0|1,0,1]=4 30 B13R1.142 CCOC1=CC=C(C=C1)CC(=O)O Z56877838 [2,0,0,0,0,0|1,0,0]=3 31 B13R1.142 CCOC1=CN=C(C=C1)CC(=O)O Z3020571152 [2,0,0,0,0,0|2,0,0]=4 32 B13R1.142 CCSC1=CC=C(C=C1)CC(=O)O Z1251117782 [2,0,0,0,0,0|1,0,0]=3 33 B13R1.142 CNCC1=CC=C(C=C1)CC(C)C Z5781254077 [2,0,0,0,0,0|2,0,0]=4 34 B13R1.585 CC(=O)C1=CC=C(C=C1)CC(C)C Z104484764 [2,0,0,0,0,0|0,0,1]=3 35 B13R1.585 CC(=O)C1=CC=C(C=C1)CN(C)C Z1198272465 [2,0,0,0,0,0|1,0,1]=4 36 B13R1.585 CC(=O)C1=CC=C(C=C1)OC(C)C Z53832962 [2,0,0,0,0,0|1,0,1]=4 37 B13R1.585 CC(=O)C1=CC=C(C=C1)SC(C)C Z600447052 [2,0,0,0,0,0|1,0,1]=4 38 B13R1.585 CC(C)CC1=CC=C(C=C1)C(=O)O Z57052892 [2,0,0,0,0,0|1,0,1]=4 39 B13R1.585 CC(C)CC1=CC=C(C=C1)C(C)N Z90122600 [2,0,0,0,0,0|1,0,0]=3 40 B13R1.585 CC(C)CC1=CC=C(C=C1)C(C)O Z228586258 [2,0,0,0,0,0|0,0,0]=2 41 B13R1.585 CC(C)OC1=CC=C(C=C1)C(C)N Z239627268 [2,0,0,0,0,0|2,0,0]=4 42 B13R1.585 CC(C)OC1=CC=C(C=C1)[C@H](C)N Z360056026 [2,0,0,0,0,0|2,0,0]=4 43 B13R1.585 CC(C)SC1=CC=C(C=C1)C(C)N Z600447098 [2,0,0,0,0,0|2,0,0]=4 44 B15R1.55 CCCCC1=CC=C(C=C1)C(C)C(=O)O Z1508926979 [1,1,0,0,0,0|0,0,0]=2 45 B15R1.1075 CC(C)CC1=CC=C(C=C1)CS(=O)(=O)C Z1010867824 [1,1,0,0,0,0|1,0,1]=4 46 B15R1.1333 COC(=O)C(N)C1=CC=C(C=C1)C(C)C Z2941167816 [0,1,0,0,1,0|1,0,0]=3 47 B15R1.3665 CC(C(=O)O)C1=CC=C(C=C1)C(F)(F)F Z792363934 [0,1,0,0,1,0|2,0,0]=4 48 B15R1.3665 CC(C(=O)O)C1=CC=C(C=C1)S(=O)(=O)C Z792377196 [0,1,0,0,1,0|2,0,0]=4 49 B15R1.3665 CC(C)(C)C1=CC=C(C=C1)C(=O)C(=O)O Z381360866 [0,1,0,0,1,0|1,0,1]=4 50 B17R1.16372 CC(C)COC1=CC=C(C=C1)C(C)(C)C(=O)N Z1151517044 [0,1,0,0,0,1|1,0,0]=3 51 B17R1.16372 CC(C)COC1=CC=C(C=C1)C(C)(C)C(=O)O Z725146436 [0,1,0,0,0,1|0,0,0]=2 52 B17R1.873 CC(C)CC1=CC=C(C=C1)C(C)NC(=O)CCl Z56347107 [0,1,0,0,0,1|1,0,0]=3 53 B17R1.873 CNC(=S)NC(C)C1=CC=C(C=C1)CC(C)C Z45910281 [0,1,0,0,0,1|1,1,0]=4 54 B17R1.26214 CC(C)CC1=CC=C(C=C1)C(C)NS(=O)(=O)C Z56166482 [0,1,0,0,0,1|1,0,1]=4 55 B15R2.4237 O=C(O)C(O)C1=CC=C(C=C1)C2CC2 Z1362824950 [1,0,0,1,0,0|1,0,0]=3 56 B15R2.4239 CC(C(=O)O)C1=CC2=C(C=C1)OCO2 Z792377310 [1,0,0,1,0,0|2,0,0]=4 57 B15R2.4239 O=C(O)C(=O)C1=CC2=C(C=C1)CCC2 Z381360930 [1,0,0,1,0,0|1,0,1]=4 58 B17R2.60546 CC(C)CC1=CC2=C(C=C1)C=C(N2)C(=O)O Z1392878633 [0,0,0,1,0,1|1,0,1]=4 59 B17R2.258284 CC(C)NC1=C(C=C2C(=C1)OC(=O)N2C)F Z2360909938 [0,1,0,1,0,0|2,0,0]=4 60 B13R1.537 CC(C)C1=CC=C(C=C1)C(C)C=O Z1198152281 [1,0,0,0,1,0|0,0,0]=2 61 B15R1.15 CCOC1=CC=C(C=C1)C(C)NC(=O)C Z212614602 [1,0,0,0,0,1|2,0,0]=4 62 B15R1.16 CCOC1=CC=C(C=C1)CC(C)C(=O)O Z1341747564 [1,0,0,0,0,1|1,0,0]=3 63 B15R1.499 CC(C)CC1=CC=C(C=C1)/C=C/C(=O)O Z2312273815 [1,0,0,0,0,1|0,0,1]=3 64 B15R1.499 CC(C)CC1=CC=C(C=C1)CCC(=O)O Z1392877280 [1,0,0,0,0,1|0,0,0]=2 65 B15R1.499 CC(C)COC1=CC=C(C=C1)CC(=O)O Z149351116 [1,0,0,0,0,1|0,0,0]=2 66 B15R1.499 CC(C)OC1=CC=C(C=C1)/C=C/C(=O)O Z2311719818 [1,0,0,0,0,1|1,0,1]=4 67 B15R1.499 CC(C)OC1=CC=C(C=C1)CCC(=O)O Z607864450 [1,0,0,0,0,1|1,0,0]=3 68 B15R1.12261 CC(C)CC1=CC(=CC=C1)C(C)C(=O)N Z2063979163 [0,0,0,0,1,1|1,0,0]=3 69 B15R1.12261 CC(C)CC1=CC(=CC=C1)C(C)C(=O)O Z1508927883 [0,0,0,0,1,1|0,0,0]=2 70 B15R1.495 CC(=O)C1=CC=C(C=C1)OC(C)C(=O)O Z56346873 [0,0,0,0,1,1|1,0,1]=4 71 B15R1.495 CC(C)C1=CC=C(C=C1)NC(=O)C(=O)O Z424779250 [0,0,0,0,1,1|1,0,1]=4 72 B15R1.495 CC(C)C1=CC=C(C=C1)SC(C)C(=O)O Z239812088 [0,0,0,0,1,1|0,0,0]=2 73 B15R1.5504 CC(C)C1=CC=C(C=C1)C(C)CC(=O)O Z352782836 [0,0,0,0,1,1|0,0,0]=2 74 B15R1.5504 CC(C)C1=CC=C(C=C1)C(N)CC(=O)O Z57465998 [0,0,0,0,1,1|1,0,0]=3 75 B17R1.9288 CC(=O)CCC1=CC=C(C=C1)OC(C)C(=O)O Z228583444 [0,0,0,0,0,2|1,0,1]=4 76 B17R1.4993 CC(C)CC1=CC=C(C=C1)C(=O)CCC(=O)O Z285137170 [0,0,0,0,0,2|1,0,1]=4 77 B17R1.26212 CC(C)OC1=CC=C(C=C1)CNC(C)C(=O)O Z821060948 [0,0,0,0,0,2|1,0,0]=3 78 B17R1.26212 CC(C)SC1=CC=C(C=C1)CSC(C)C(=O)N Z1635271136 [0,0,0,0,0,2|2,0,0]=4 79 B17R1.26212 CC(NCC1=CC=C(C=C1)CN(C)C)C(=O)O Z2997507806 [0,0,0,0,0,2|1,0,0]=3