0 B13R1.464 CCOC(=O)C1=CC=CN=C1NN BB57-2450 [0,0,0,0,0,0|2,0,0]=2 1 B12R1.77 CCC(=O)C1=C(OC)C=CC=C1 BB54-5278 [1,0,0,0,0,0|1,0,0]=2 2 B12R1.77 COC(=O)C1=CC=CC=C1CBr BB57-2114 [1,0,0,0,0,0|2,0,0]=3 3 B12R1.308 CCNC(=O)C1=CC=CN=C1Cl BB55-2908 [1,0,0,0,0,0|3,0,0]=4 4 B12R1.308 CCOC(=N)C1=CC=CNC1=O BB57-4242 [1,0,0,0,0,0|3,0,0]=4 5 B12R1.308 CCOC(=O)C1=C(O)N=CN=C1 BB12-4373 [1,0,0,0,0,0|3,0,0]=4 6 B12R1.308 CCOC(=O)C1=CN=CNC1=O BB10-0383 [1,0,0,0,0,0|3,0,0]=4 7 B12R1.316 CCOC(=O)C1=C(CN)C=CO1 BB54-1168 [0,0,0,0,1,0|3,0,0]=4 8 B12R1.316 CCOC(=O)C1=CC=NN1CC BB05-4979 [0,0,0,0,1,0|3,0,0]=4 9 B12R1.316 CCOC(=O)C1=CC=NN1CC BB58-3473 [0,0,0,0,1,0|3,0,0]=4 10 B11R1.41 CCOC1=C(NC)C=CC=C1 BB01-7289 [2,0,0,0,0,0|0,0,0]=2 11 B11R1.41 CCOC1=CC=CC=C1NN BB01-6125 [2,0,0,0,0,0|1,0,0]=3 12 B11R1.41 CCOC1=CC=CC=C1NN BB56-0057 [2,0,0,0,0,0|1,0,0]=3 13 B11R1.53 CNC1=CC=CC=C1[N+](=O)[O-] BB12-2791 [2,0,0,0,0,0|1,0,1]=4 14 B11R1.53 CNC1=NC=CC=C1C(=O)O BB12-3552 [2,0,0,0,0,0|1,0,0]=3 15 B11R1.53 NCC1=CC=CC=C1C(=O)O BB54-2018 [2,0,0,0,0,0|2,0,0]=4 16 B11R1.53 NNC1=CC=CC=C1C(=O)O BB12-2554 [2,0,0,0,0,0|1,0,0]=3 17 B11R1.53 O=[IH2]C1=CC=CC=C1C(=O)O BB58-3100 [2,0,0,0,0,0|2,0,0]=4 18 B11R1.222 CCC(N)C1=CC=CC=C1C BB58-0612 [2,0,0,0,0,0|1,0,1]=4 19 B11R1.222 COC(=O)C1=C(S)C=CC=C1 BB12-1508 [2,0,0,0,0,0|1,0,0]=3 20 B11R1.222 COC(=O)C1=NC=CC=C1O BB17-0205 [2,0,0,0,0,0|2,0,0]=4 21 B11R1.16 CCOC(=O)C1=CC=NC=C1 BB12-2749 [2,0,0,0,0,0|1,0,0]=3 22 B13R1.547 CCC(=O)C1=CC=CC=C1C(=O)O BB57-6520 [1,1,0,0,0,0|2,0,0]=4 23 B13R1.2357 COC(=O)C1=C(OC)C=CC=C1C BB57-2069 [1,1,0,0,0,0|1,0,0]=3 24 B13R1.572 CCNCC1=C(N(C)C)C=CC=C1 BB57-1492 [1,1,0,0,0,0|1,0,1]=4 25 B13R1.201 CC(C)NC(=O)C1=CC=CC=C1N BB54-2440 [1,1,0,0,0,0|1,0,0]=3 26 B13R1.446 CCOC(=O)C1=C(Cl)N=CC(Cl)=C1 BB54-1154 [1,1,0,0,0,0|2,0,0]=4 27 B13R1.446 CCOC(=O)C1=C(O)C=CC(Br)=C1 BB12-2893 [1,1,0,0,0,0|1,0,0]=3 28 B13R1.696 CNC(=O)C(=O)C1=C(C)C=CC=C1 BB12-1629 [1,1,0,0,0,0|2,0,0]=4 29 B13R1.1511 CCOC(=O)C1=C(N)NC(=S)N=C1 BB54-0845 [1,1,0,0,0,0|2,0,0]=4 30 B13R1.1511 CCOC(=O)C1=C(O)C=C(O)N=C1 BB12-2179 [1,1,0,0,0,0|2,0,0]=4 31 B15R1.1147 CCC1=C(NC(=O)C(Br)CC)C=CC=C1 BB01-5189 [0,1,0,0,0,1|2,0,0]=4 32 B15R1.9725 CCOC(=O)NC1=C(OC)C=C(N)C=C1 BB57-6953 [0,1,0,0,0,1|1,0,0]=3 33 B13R2.32 NN1CNC2=CC=CC=C2C1=O BB17-1096 [1,0,0,1,0,0|2,0,0]=4 34 B13R2.3085 CN1C(=O)C(=O)C2=CC=CC=C21 BB12-1449 [1,0,0,1,0,0|1,0,1]=4 35 B13R2.328 CC1=NC2=CC=CC=C2C(=O)O1 BB55-4970 [1,0,0,1,0,0|0,0,2]=4 36 B15R2.73 CCOC(=O)C1=NNC2=CC=CC=C21 BB90-0121 [0,0,0,1,0,1|1,0,0]=3 37 B15R2.7340 CN1C(=O)CNC(=O)C2=CC=CC=C21 BB12-4119 [0,1,0,1,0,0|1,0,1]=4 38 B15R2.13167 CC1NC(=O)C2=CC=CC=C2NC1=O BB52-7063 [0,1,0,1,0,0|1,0,1]=4 39 B11R1.199 CCOC(=O)C1=C(C)N=CO1 BB54-1776 [1,0,0,0,1,0|2,0,0]=4 40 B11R1.199 CCOC(=O)C1=C(C)NC=C1 BB57-2152 [1,0,0,0,1,0|1,0,0]=3 41 B11R1.199 CCOC(=O)C1=C(C)NC=N1 BB26-0240 [1,0,0,0,1,0|2,0,0]=4 42 B11R1.199 CCOC(=O)C1=C(C)SC=N1 BB57-3717 [1,0,0,0,1,0|2,0,0]=4 43 B11R1.199 CCOC(=O)C1=C(N)ON=C1 BB54-2054 [1,0,0,0,1,0|2,0,0]=4 44 B11R1.199 CCOC(=O)C1=C(N)SC=C1 BB55-1541 [1,0,0,0,1,0|1,0,0]=3 45 B11R1.199 CCOC(=O)C1=NC=CN1C BB54-1363 [1,0,0,0,1,0|2,0,0]=4 46 B11R1.199 CCOC(=O)C1=NNC=C1N BB54-1692 [1,0,0,0,1,0|2,0,0]=4