0 B15R1.8948 CC(C)(C(=O)O)C1=CC=C(C=C1)[N+](=O)[O-] Z1238548160 [0,0,0,0,0,0|2,0,1]=3 1 B14R1.213 CCC1=CC=C(C=C1)C(C)(C)C(=O)O Z992734918 [1,0,0,0,0,0|2,0,1]=4 2 B14R1.213 COC1=CC=C(C=C1)C(C)(C)C(=O)O Z725146374 [1,0,0,0,0,0|3,0,0]=4 3 B14R1.213 COC1=CC=C(C=C1)C(C)(N)C(=O)O Z1259340008 [1,0,0,0,0,0|2,0,0]=3 4 B14R1.307 CC(C)(C#N)C1=CC=C(C=C1)C(=O)O Z1255366114 [1,0,0,0,0,0|2,0,1]=4 5 B14R1.307 CCC(C)(C)C1=CC=C(C=C1)C(=O)O Z1198218373 [1,0,0,0,0,0|2,0,1]=4 6 B14R1.6402 CC(=O)N(C)C1=CC=C(C=C1)C(=O)O Z1262515023 [1,0,0,0,0,0|2,0,0]=3 7 B14R1.6402 CC(C(=O)O)C1=CC=C(C=C1)N(C)C Z792363902 [1,0,0,0,0,0|3,0,0]=4 8 B14R1.6402 CN(C(=N)N)C1=CC=C(C=C1)C(=O)O Z3016456893 [1,0,0,0,0,0|3,0,0]=4 9 B16R1.12254 CC(N)(C(=O)O)C1=CC=C(C=C1)C(F)(F)F Z234896479 [0,1,0,0,0,0|2,0,1]=4 10 B16R1.12254 CC(N)(C(=O)O)C1=CC=C(C=C1)S(=O)(=O)C Z317024832 [0,1,0,0,0,0|1,0,1]=3 11 B16R2.3947 CC1(C(=O)NC2=C1C=CC(=C2)C(=O)O)C Z1508956431 [0,0,0,1,0,0|2,0,0]=3 12 B16R2.144304 NC(=O)C1=CC=C(C=C1)C2(CC2)C(=O)O Z1509052334 [0,0,0,1,0,0|2,0,0]=3 13 B16R2.144304 O=C(O)C1(CC1)C2=CC=C(C=C2)[N+](=O)[O-] Z1353209215 [0,0,0,1,0,0|2,0,1]=4 14 B16R1.12329 CC(C)(NC1=CC=C(C=C1)[N+](=O)[O-])C(=O)O Z801823576 [0,0,0,0,0,1|2,0,1]=4 15 B16R1.12444 CC(N)(CC(=O)O)C1=CC=C(C=C1)[N+](=O)[O-] Z1824565558 [0,0,0,0,0,1|1,0,1]=3 16 B16R1.18085 CC(C)CC1=CC=C(C=C1)C(C)(N)C(=O)O Z234896481 [0,0,0,0,0,1|2,0,1]=4 17 B13R1.36 CC(C(=O)O)C1=CC=C(C=C1)C=O Z1198177006 [2,0,0,0,0,0|0,0,0]=2 18 B13R1.36 CCC1=CC=C(C=C1)C(C)C(=O)O Z792377226 [2,0,0,0,0,0|1,0,1]=4 19 B13R1.36 CCC1=CC=C(C=C1)C(N)C(=O)O Z317024600 [2,0,0,0,0,0|1,0,1]=4 20 B13R1.36 COC1=CC=C(C=C1)C(C)C(=O)O Z792377298 [2,0,0,0,0,0|2,0,0]=4 21 B13R1.36 COC1=CC=C(C=C1)C(N)C(=O)O Z56755722 [2,0,0,0,0,0|2,0,0]=4 22 B13R1.36 NC(C(=O)O)C1=CC=C(C=C1)CO Z2510296391 [2,0,0,0,0,0|0,0,1]=3 23 B13R1.522 CC(C)(C(=O)O)C1=CC=C(C=C1)Br Z415660212 [2,0,0,0,0,0|2,0,0]=4 24 B13R1.522 CC(C)(C(=O)O)C1=CC=C(C=C1)Cl Z606339610 [2,0,0,0,0,0|2,0,0]=4 25 B13R1.522 CC(C)(C(=O)O)C1=CC=C(C=C1)F Z725146444 [2,0,0,0,0,0|2,0,0]=4 26 B13R1.522 CC(C)(C(=O)O)C1=CC=C(C=C1)N Z1235993363 [2,0,0,0,0,0|2,0,0]=4 27 B13R1.522 CC(C)(C(=O)O)C1=CC=C(C=C1)O Z1258981351 [2,0,0,0,0,0|1,0,0]=3 28 B13R1.522 CC(N)(C(=O)O)C1=CC=C(C=C1)Br Z317024914 [2,0,0,0,0,0|1,0,0]=3 29 B13R1.522 CC(N)(C(=O)O)C1=CC=C(C=C1)Cl Z317024852 [2,0,0,0,0,0|1,0,0]=3 30 B13R1.522 CC(N)(C(=O)O)C1=CC=C(C=C1)F Z317024742 [2,0,0,0,0,0|1,0,0]=3 31 B13R1.522 CC(N)(C(=O)O)C1=CC=C(C=C1)O Z1255523384 [2,0,0,0,0,0|0,0,0]=2 32 B13R1.522 CC(O)(C(=O)O)C1=CC=C(C=C1)Cl Z788000388 [2,0,0,0,0,0|2,0,0]=4 33 B13R1.522 CC(O)(C(=O)O)C1=CC=C(C=C1)F Z788000970 [2,0,0,0,0,0|2,0,0]=4 34 B13R1.522 CC1=CC=C(C=C1)C(C)(C)C(=O)O Z725146466 [2,0,0,0,0,0|1,0,1]=4 35 B13R1.338 CC(=O)C1=CC=C(C=C1)C(C)(C)O Z1238572199 [2,0,0,0,0,0|2,0,0]=4 36 B13R1.338 CC(C)(C)C1=CC=C(C=C1)C(=O)O Z104473486 [2,0,0,0,0,0|1,0,1]=4 37 B13R1.338 CC(C)(O)C1=CC=C(C=C1)C(=O)O Z1198159906 [2,0,0,0,0,0|1,0,0]=3 38 B13R1.338 CC(F)(F)C1=CC=C(C=C1)C(=O)O Z1262522751 [2,0,0,0,0,0|2,0,0]=4 39 B13R1.338 CS(=O)(=O)C1=CC=C(C=C1)C(=O)O Z57042070 [2,0,0,0,0,0|2,0,0]=4 40 B13R1.338 C[S@](=N)(=O)C1=CC=C(C=C1)C(=O)O Z3486437907 [2,0,0,0,0,0|1,0,1]=4 41 B13R1.338 NS(=O)(=O)C1=CC=C(C=C1)C(=O)O Z53021532 [2,0,0,0,0,0|2,0,0]=4 42 B13R1.537 CCC(C)C1=CC=C(C=C1)C(=O)O Z285150268 [2,0,0,0,0,0|1,0,1]=4 43 B13R1.585 CC(=O)C1=CC=C(C=C1)CC(=O)O Z382690832 [2,0,0,0,0,0|1,0,0]=3 44 B13R1.585 CC(=O)NC1=CC=C(C=C1)C(=O)O Z57042001 [2,0,0,0,0,0|2,0,0]=4 45 B13R1.585 CC(=O)OC1=CC=C(C=C1)C(=O)O Z57169570 [2,0,0,0,0,0|2,0,0]=4 46 B13R1.585 CS(=O)C1=CC=C(C=C1)CC(=O)O Z1251124311 [2,0,0,0,0,0|2,0,0]=4 47 B13R1.585 NC(=O)C1=NC=C(C=C1)CC(=O)O Z2688975468 [2,0,0,0,0,0|2,0,0]=4 48 B13R1.585 NC(=O)CC1=CC=C(C=C1)C(=O)O Z1255359559 [2,0,0,0,0,0|1,0,0]=3 49 B13R1.585 NC(=O)NC1=CC=C(C=C1)C(=O)O Z56896940 [2,0,0,0,0,0|2,0,0]=4 50 B13R1.585 O=C(O)CC1=CC=C(C=C1)B(O)O Z1198162651 [2,0,0,0,0,0|1,0,1]=4 51 B13R1.585 O=C(O)CC1=CC=C(C=C1)[N+](=O)[O-] Z104477118 [2,0,0,0,0,0|1,0,1]=4 52 B15R1.213 COC(=O)C(C)(N)C1=CC=C(C=C1)OC Z477335840 [1,1,0,0,0,0|2,0,0]=4 53 B15R1.215 CCC1=CC=C(C=C1)C(N)(CC)C(=O)O Z414323652 [1,1,0,0,0,0|1,0,1]=4 54 B15R1.1333 C=CC(=O)N(C)C1=CC=C(C=C1)C(=O)O Z1688646494 [1,1,0,0,0,0|2,0,0]=4 55 B15R1.1354 COC(C(=O)O)C1=CC=C(C=C1)B(O)O Z4580643462 [1,1,0,0,0,0|1,0,1]=4 56 B15R1.3665 CC(C(=O)O)C1=CC=C(C=C1)S(=O)(=O)C Z792377196 [1,1,0,0,0,0|1,0,1]=4 57 B15R2.961 CN1C(=O)NC2=C1C=CC(=C2)C(=O)O Z327223546 [1,0,0,1,0,0|2,0,0]=4 58 B17R2.45302 O=C(O)C1(CC1)C2=CC=C(C=C2)S(=O)(=O)O Z2467667136 [0,1,0,1,0,0|2,0,0]=4 59 B15R1.216 O=CC1=CC=C(C=C1)OC(F)(F)C(=O)O Z445134782 [1,0,0,0,0,1|2,0,0]=4 60 B15R1.495 CC(=O)C1=CC=C(C=C1)OC(C)C(=O)O Z56346873 [1,0,0,0,0,1|1,0,0]=3 61 B15R1.495 CC(OC1=CC=C(C=C1)C(=O)N)C(=O)N Z18242759 [1,0,0,0,0,1|2,0,0]=4 62 B15R1.495 CC(SC1=CC=C(C=C1)[N+](=O)[O-])C(=O)O Z31250559 [1,0,0,0,0,1|1,0,1]=4 63 B15R1.5504 CC(=O)N[C@H](C)C1=CC=C(C=C1)C(=O)O Z1508938788 [1,0,0,0,0,1|1,0,0]=3 64 B15R1.8983 CC(N)(C(=O)O)C1=CC(=CC=C1)[N+](=O)[O-] Z2616442229 [0,0,0,0,1,1|1,0,1]=4