0 B14R2.11645 CCC1=C2NC(=O)C(=O)C2=CC=C1 SBB108802 [0,0,0,0,0,0|2,0,1]=3 1 B13R2.581 COC1=CC=CC2=C1N=C(N)S2 SBB000220 [1,0,0,0,0,0|2,0,1]=4 2 B13R2.4825 CC1=C2NC(=O)C(=O)C2=CC=C1 SBB002431 [1,0,0,0,0,0|1,0,1]=3 3 B13R2.4825 O=C1NC2=C(C=CC=C2Br)C1=O SBB066728 [1,0,0,0,0,0|2,0,1]=4 4 B13R2.4825 O=C1NC2=C(C=CC=C2F)C1=O SBB067159 [1,0,0,0,0,0|2,0,1]=4 5 B13R2.4825 O=C1NC2=C(Cl)C=CC=C2C1=O SBB045989 [1,0,0,0,0,0|2,0,1]=4 6 B13R1.91 CCC1=C(NC(=S)NN)C=CC=C1 SBB017742 [0,0,1,0,0,0|2,1,0]=4 7 B13R1.91 CCC1=CC=CC=C1NC(=O)CCl SBB004528 [0,0,1,0,0,0|3,0,0]=4 8 B13R1.91 COC1=C(NC(=O)CBr)C=CC=C1 SBB050431 [0,0,1,0,0,0|2,0,0]=3 9 B13R1.91 COC1=CC=CC=C1NC(=O)CCl SBB004505 [0,0,1,0,0,0|2,0,0]=3 10 B13R1.91 COC1=CC=CC=C1NC(=S)NN SBB017752 [0,0,1,0,0,0|1,1,0]=3 11 B13R1.91 CSC1=C(NC(=O)CCl)C=CC=C1 SBB046908 [0,0,1,0,0,0|2,1,0]=4 12 B15R2.20937 COC1=C2N=C(C)C=C(O)C2=CC=C1 SBB079264 [0,0,0,0,0,1|2,0,1]=4 13 B12R1.435 COC1=CC(C(=O)C=O)=CC=C1 SBB087783 [1,0,1,0,0,0|1,0,1]=4 14 B12R1.440 COC1=C(C)C(C(=O)O)=CC=C1 SBB064170 [1,0,1,0,0,0|2,0,0]=4 15 B12R1.440 COC1=C(O)C(C(=O)O)=CC=C1 SBB063040 [1,0,1,0,0,0|2,0,0]=4 16 B12R1.440 COC1=CC=CC(C(=O)O)=C1F SBB052782 [1,0,1,0,0,0|2,0,0]=4 17 B12R1.75 CCC1=C(NC(C)=O)C=CC=C1 SBB058947 [1,0,1,0,0,0|2,0,0]=4 18 B12R1.75 CCC1=C(NC(N)=O)C=CC=C1 SBB087812 [1,0,1,0,0,0|1,0,0]=3 19 B12R1.75 COC1=C(NC(N)=S)C=CC=C1 SBB055318 [1,0,1,0,0,0|0,1,0]=3 20 B12R1.75 COC1=CC=CC=C1CC(=O)O SBB063364 [1,0,1,0,0,0|1,0,0]=3 21 B12R1.75 COC1=CC=CC=C1CC(N)=S SBB089825 [1,0,1,0,0,0|1,1,0]=4 22 B12R1.75 COC1=CC=CC=C1NC(N)=O SBB087990 [1,0,1,0,0,0|0,0,0]=2 23 B12R1.371 CC1=C(NC(=O)CCl)C=CC=C1 SBB004515 [1,0,1,0,0,0|2,0,0]=4 24 B12R1.371 CC1=CC=CC=C1NC(=S)NN SBB038378 [1,0,1,0,0,0|1,1,0]=4 25 B12R1.371 CCC(=O)NC1=CC=CC=C1O SBB080002 [1,0,1,0,0,0|2,0,0]=4 26 B12R1.371 NNC(=O)NC1=CC=CC=C1O SBB023488 [1,0,1,0,0,0|1,0,0]=3 27 B12R1.371 O=C(CCl)NC1=CC=CC=C1O SBB072362 [1,0,1,0,0,0|2,0,0]=4 28 B12R1.438 COC1=CC(NC(C)=O)=CC=C1 SBB080674 [1,0,1,0,0,0|1,0,0]=3 29 B12R1.438 COC1=CC=CC(CC(=O)O)=C1 SBB042511 [1,0,1,0,0,0|2,0,0]=4 30 B12R1.438 COC1=CC=CC(CC(N)=S)=C1 SBB055060 [1,0,1,0,0,0|1,1,0]=4 31 B12R1.438 COC1=CC=CC(NC(N)=O)=C1 SBB087993 [1,0,1,0,0,0|0,0,0]=2 32 B12R1.438 CSC1=CC(NC(C)=O)=CC=C1 SBB115887 [1,0,1,0,0,0|1,1,0]=4 33 B12R1.1879 C(=O)C1=C(OC)C=CC=C1OC SBB006541 [1,0,1,0,0,0|2,0,0]=4 34 B12R2.315 CCC1=C2NC=CC2=CC=C1 SBB007573 [2,0,0,0,0,0|2,0,0]=4 35 B12R2.315 COC1=C2C=CNC2=CC=C1 SBB055969 [2,0,0,0,0,0|1,0,0]=3 36 B12R2.315 COC1=C2NC=CC2=CC=C1 SBB055971 [2,0,0,0,0,0|1,0,0]=3 37 B12R2.315 COC1=C2NC=CC2=CC=N1 SBB056382 [2,0,0,0,0,0|2,0,0]=4 38 B12R2.202 CC1=C2N=C(S)NC2=CC=C1 SBB046525 [2,0,0,0,0,0|0,1,1]=4 39 B12R2.202 O=C1CC2=C(C=CC=C2Cl)N1 SBB054564 [2,0,0,0,0,0|2,0,0]=4 40 B12R2.202 O=C1CC2=CC=CC(F)=C2N1 SBB086757 [2,0,0,0,0,0|2,0,0]=4 41 B12R2.18 CN1C(=O)CC2=CC=CC=C21 SBB006878 [2,0,0,0,0,0|2,0,0]=4 42 B12R2.18 CN1C(=O)OC2=C1C=CC=C2 SBB017054 [2,0,0,0,0,0|2,0,0]=4 43 B12R2.18 CN1C(=O)SC2=C1C=CC=C2 SBB071442 [2,0,0,0,0,0|2,0,0]=4 44 B12R2.18 CN1C(=S)NC2=CC=CC=C21 SBB018392 [2,0,0,0,0,0|1,1,0]=4 45 B12R2.18 O=C1NC2=C(C=CC=C2)C1=O SBB009100 [2,0,0,0,0,0|1,0,1]=4 46 B14R1.483 CCOC1=C(NC(=S)NC)C=CC=C1 SBB000502 [0,1,1,0,0,0|1,1,0]=4 47 B14R1.483 CCOC1=CC=CC=C1NC(=O)CCl SBB027548 [0,1,1,0,0,0|2,0,0]=4 48 B14R1.965 CCC1=C(NC(=O)\C=N\O)C=CC=C1 SBB108798 [0,1,1,0,0,0|1,0,1]=4 49 B14R1.965 CCNC(=S)NC1=C(OC)C=CC=C1 SBB000501 [0,1,1,0,0,0|1,1,0]=4 50 B14R1.965 COC1=C(NC(=O)CC#N)C=CC=C1 SBB042444 [0,1,1,0,0,0|2,0,0]=4 51 B14R1.965 COC1=C(NC(=O)\C=N\O)C=CC=C1 SBB108755 [0,1,1,0,0,0|0,0,1]=3 52 B14R1.3135 CCC1=C(NC(=O)C(=O)O)C=CC=C1 SBB049959 [0,1,1,0,0,0|2,0,0]=4 53 B14R1.3279 COC1=C(NC(=S)NN)C=C(C)C=C1 SBB017775 [0,1,1,0,0,0|1,1,0]=4 54 B14R1.3279 COC1=CC=C(C)C=C1NC(=O)CCl SBB004518 [0,1,1,0,0,0|2,0,0]=4 55 B14R1.3279 COC1=CC=C(Cl)C=C1NC(=O)CCl SBB108484 [0,1,1,0,0,0|2,0,0]=4 56 B14R1.3417 COC(=O)NC1=C(OC)C=C(N)C=C1 SBB072875 [0,1,1,0,0,0|2,0,0]=4 57 B14R1.41 OC(=O)C(O)C1=CC(OC)=C(O)C=C1 SBB017532 [0,1,1,0,0,0|2,0,0]=4 58 B14R2.1072 COC1=CC=CC2=C1NC=C2C=O SBB005313 [1,1,0,0,0,0|1,0,1]=4 59 B14R2.2151 C(=O)C1=C(C)C2=CC=CC(C)=C2N1 SBB048904 [1,1,0,0,0,0|2,0,0]=4 60 B14R2.8620 CC1=C2NC(=O)C(=O)C2=C(C)C=C1 SBB050394 [1,1,0,0,0,0|1,0,1]=4 61 B14R2.8620 CC1=CC=C(Cl)C2=C1NC(=O)C2=O SBB066723 [1,1,0,0,0,0|1,0,1]=4 62 B14R2.8737 CC1=C(C)C2=C(C=C1)C(=O)C(=O)N2 SBB072811 [1,1,0,0,0,0|1,0,1]=4 63 B14R2.8737 CC1=C(Cl)C=CC2=C1NC(=O)C2=O SBB066731 [1,1,0,0,0,0|1,0,1]=4 64 B14R2.9184 CC1=C2NC(=O)C(=O)C2=CC(Br)=C1 SBB002521 [1,1,0,0,0,0|1,0,1]=4 65 B14R2.9184 CC1=C2NC(=O)C(=O)C2=CC(Cl)=C1 SBB054713 [1,1,0,0,0,0|1,0,1]=4 66 B14R2.9184 N1C(=O)C(=O)C2=C1C(C)=CC(C)=C2 SBB005805 [1,1,0,0,0,0|1,0,1]=4 67 B14R2.28485 CC1=C2C(=CC=C1)C(=O)C(=O)N2C SBB013576 [1,1,0,0,0,0|1,0,1]=4 68 B16R2.36584 COC1=C2C=C(C(=O)O)N(C)C2=CC=C1 SBB301799 [0,2,0,0,0,0|2,0,0]=4 69 B16R2.36584 COC1=C2NC(C(=O)O)=C(C)C2=CC=C1 SBB048939 [0,2,0,0,0,0|2,0,0]=4 70 B14R2.3274 COC1=CC=C2NC(=O)C(=O)C2=C1 SBB067262 [0,0,1,1,0,0|1,0,1]=4 71 B14R2.11689 COC1=CC=CC2=C1C(C=O)=CN2 SBB005311 [0,0,1,1,0,0|2,0,0]=4 72 B12R1.77 CCC(=O)C1=CC=CC=C1OC SBB019455 [0,0,1,0,1,0|2,0,0]=4 73 B12R1.77 COC(=O)C1=CC=CC=C1OC SBB061390 [0,0,1,0,1,0|2,0,0]=4 74 B12R1.77 COC1=C(C(=O)CBr)C=CC=C1 SBB040611 [0,0,1,0,1,0|2,0,0]=4 75 B12R1.77 COC1=C(C(=O)NN)C=CC=C1 SBB017611 [0,0,1,0,1,0|1,0,0]=3 76 B12R1.77 COC1=CC=CC=C1\C(N)=N/O SBB076113 [0,0,1,0,1,0|1,0,1]=4 77 B14R1.863 COC1=CC=CC=C1NCC(=O)NN SBB111850 [0,0,1,0,0,1|1,0,0]=3 78 B14R1.863 COC1=CC=CC=C1OCC(=O)NN SBB000352 [0,0,1,0,0,1|2,0,0]=4