0 B22R3.253815 O=C(C[N+]1=CC2=C(C=CC=C2)C=C1)C3=CC=CC=C3O R946028 [0,0,0,0,0,0|3,0,0]=3 1 B22R3.253815 O=C(NC1=CC2=C(C=CC=C2)C=C1)C3=CC=CC=C3Cl S854743 [0,0,0,0,0,0|2,0,0]=2 2 B21R3.24492 O=C(C[N+]1=CC2=C(C=CC=C2)C=C1)C3=CC=CC=C3 S135453 [1,0,0,0,0,0|2,0,0]=3 3 B21R3.24492 O=C(C[N+]1=CC2=C(C=CC=C2)C=C1)C3=CC=CC=C3 S644897 [1,0,0,0,0,0|2,0,0]=3 4 B21R3.24492 O=C(NC1=CC2=C(C=CC=C2)C=C1)C3=CC=CC=C3 R531286 [1,0,0,0,0,0|1,0,0]=2 5 B21R3.24492 O=C(OC1=CC2=C(C=CC=C2)C=C1)C3=CC=CC=C3 S706752 [1,0,0,0,0,0|0,0,0]=1 6 B21R3.218733 BrC1=CC=CC=C1/C=C\C2=CC3=C(C=CC=C3)C=C2 T304204 [1,0,0,0,0,0|2,0,0]=3 7 B21R3.218733 OC1=C(C=CC=C1)C=NC2=CC3=C(C=CC=C3)C=C2 S31292 [1,0,0,0,0,0|2,0,0]=3 8 B23R3.168032 CC1=CC=C(C(=C1)C)C(=O)C[N+]2=CC3=C(C=CC=C3)C=C2 L125202 [0,1,0,0,0,0|3,0,0]=4 9 B23R3.823020 O=C(NC1=CN=C2C=CC=CC2=C1)C3=C(C=CC(=C3)Br)F T112984 [0,1,0,0,0,0|3,0,0]=4 10 B23R4.2027607 NC1=C(C=CC=C1)N2N=C3C=CC4=CC=CC=C4C3=N2 S544493 [0,0,0,1,0,0|3,0,0]=4 11 B23R3.157683 CC1=C(C=CC=C1)NC(=O)OC2=CC3=C(C=CC=C3)C=C2 S555401 [0,0,0,0,0,1|1,0,0]=2 12 B23R3.157683 O=C(C[N+]1=CC2=C(C=CC=C2)C=C1)NC3=C(C=CC=C3)F R744654 [0,0,0,0,0,1|3,0,0]=4 13 B23R3.157683 O=C(NC1=C(C=CC=C1)Cl)OC2=CC3=C(C=CC=C3)C=C2 S724661 [0,0,0,0,0,1|1,0,0]=2 14 B20R3.30190 C(=C/C1=CC2=C(C=CC=C2)C=C1)\C3=CC=CC=C3 R365246 [2,0,0,0,0,0|1,0,0]=3 15 B20R3.30190 C1=CC=C(C=C1)/C=N/C2=CC3=C(C=CC=C3)C=C2 S841145 [2,0,0,0,0,0|1,0,0]=3 16 B20R3.30190 C1=CC=C(C=C1)COC2=CC3=C(C=CC=C3)C=C2 S646210 [2,0,0,0,0,0|0,0,1]=3 17 B22R3.46008 CC1=CC=C(C=C1)C(=O)C[N+]2=CC3=C(C=CC=C3)C=C2 S135437 [1,1,0,0,0,0|2,0,0]=4 18 B22R3.46008 O=C(C[N+]1=CC2=C(C=CC=C2)C=C1)C3=CC=C(C=C3)Cl S239968 [1,1,0,0,0,0|2,0,0]=4 19 B22R3.46008 O=C(C[N+]1=CC=C2C=CC=CC2=C1)C3=CC=C(C=C3)Br S248347 [1,1,0,0,0,0|2,0,0]=4 20 B22R3.46008 O=C(C[N+]1=CC=C2C=CC=CC2=C1)C3=CC=C(C=C3)F S248525 [1,1,0,0,0,0|2,0,0]=4 21 B22R3.46008 O=C(NC1=CC2=C(C=CC=C2)C=C1)C3=CC=C(C=C3)F S801321 [1,1,0,0,0,0|1,0,0]=3 22 B22R3.46008 O=C(NC1=CC2=CC=CC=C2C=C1)C3=CC=C(C=C3)Cl S555460 [1,1,0,0,0,0|1,0,0]=3 23 B22R3.242340 O=C1C=CC2=C(O1)C=C(C=C2)OC(=O)C3=CC=NC=C3 R735795 [1,1,0,0,0,0|2,0,0]=4 24 B22R3.242707 O=C1C=CC2=C(O1)C=CC(=C2)OC(=O)C3=CC=CN=C3 R733881 [1,1,0,0,0,0|2,0,0]=4 25 B22R3.707668 O=C(C[N+]1=CC2=C(C=CC=C2)C=C1)C3=CC=CC(=C3)Br R762687 [1,1,0,0,0,0|2,0,0]=4 26 B22R3.707668 O=C(NC1=CC2=C(C=CC=C2)C=C1)C3=CC(=CC=C3)Cl L319724 [1,1,0,0,0,0|1,0,0]=3 27 B22R3.707668 O=C(NC1=CC2=C(C=CC=C2)C=C1)C3=CC=CC(=C3)F S801291 [1,1,0,0,0,0|1,0,0]=3 28 B22R3.3256750 CC(C(=O)C1=CC=CC=C1)[N+]2=CC3=C(C=CC=C3)C=C2 S321176 [1,1,0,0,0,0|2,0,0]=4 29 B22R3.261823 OC1=CC(=C(C=C1)/C=N/C2=CC3=CC=CC=C3C=C2)O R702404 [1,1,0,0,0,0|2,0,0]=4 30 B22R3.339344 ClC1=CC=CC(=C1/C=N/C2=CC3=CC=CC=C3C=C2)Cl R702277 [1,1,0,0,0,0|2,0,0]=4 31 B22R3.718993 OC1=C(C=C(C=C1)Br)/C=N/C2=CC3=C(C=CC=C3)C=C2 R531952 [1,1,0,0,0,0|2,0,0]=4 32 B24R3.2144004 COC1=C(C=CC=C1)NC(=O)OC2=CC3=C(C=CC=C3)C=C2 S891789 [0,1,0,0,0,1|1,0,0]=3 33 B24R3.2446257 CC1=CC(=C(C=C1)C)NC(=O)OC2=CC3=C(C=CC=C3)C=C2 S847356 [0,1,0,0,0,1|1,0,0]=3 34 B24R3.12022742 O=C(NC1=CC=C(C=C1F)F)OC2=CC3=C(C=CC=C3)C=C2 S700258 [0,1,0,0,0,1|1,0,0]=3 35 B24R3.26725364 O=C(COC1=CC2=CC=CC=C2C=C1)C3=C(C=C(C=C3)O)O OTV000196 [0,1,0,0,0,1|1,0,0]=3 36 B24R3.436631 O=C(O)C1=CC=CC=C1C(=O)NC2=CC3=CC=CC=C3C=C2 T112283 [0,2,0,0,0,0|2,0,0]=4 37 B22R3.791519 O=C(NC1=CC=CC=C1)OC2=CC3=C(C=CC=C3)C=C2 S875090 [0,0,1,1,0,0|2,0,0]=4 38 B22R3.12007 CC1=C(C=CC=C1)C(=O)NC2=CC=CC3=C2C=CC=C3 L130699 [0,0,1,1,0,0|2,0,0]=4 39 B22R3.12007 O=C(NC1=CC=CC2=C1C=CC=C2)C3=CC=CC=C3F S743984 [0,0,1,1,0,0|2,0,0]=4 40 B22R4.779058 CC1=CC2=C(C3=CC=CC=C3C=C2)C4=C1C=CC=C4 S936049 [1,0,0,1,0,0|2,0,0]=4 41 B22R4.562900 CC1=CC=CC2=C1C=CC3=CC4=C(C=CC=C4)C=C23 S936081 [1,0,0,1,0,0|2,0,0]=4 42 B22R4.568091 CC1=CC=CC2=C1C=CC3=C2C4=CC=CC=C4C=C3 S936030 [1,0,0,1,0,0|2,0,0]=4 43 B22R4.3225226 C1=CC2=C(C=C1)C=C(C=C2)C3=CC4=C(S3)C=CC=C4 S320323 [1,0,0,1,0,0|2,0,0]=4 44 B22R4.3225226 C1=CC2=C(C=C1)C=C(C=C2)C3=CC4=C(S3)C=CC=C4 S364053 [1,0,0,1,0,0|2,0,0]=4 45 B22R4.279643 ClC1=C2C=C3C=CC=CC3=CC2=NC4=C1C=CC=C4 PH005776 [0,0,0,1,1,0|1,0,1]=4 46 B24R4.6842364 C1=CC=C2C=C(C=CC2=C1)OC3=CC=C4C=CC=CC4=C3 TMT00661 [0,0,0,1,0,1|2,0,0]=4 47 B24R4.3646782 O=C1NC(NC2=C1C=CC=C2)C3=CC4=C(C=CC=C4)C=C3 S542288 [0,0,0,1,0,1|1,0,0]=3 48 B24R4.21671907 O=C1C2=C(C=CC=C2)C(=O)C1C3=CC4=C(C=CC=C4)C=C3 R243949 [0,1,0,1,0,0|2,0,0]=4 49 B24R4.21671907 O=C1C2=C(C=CC=C2)C(=O)N1C3=CC4=C(C=CC=C4)C=C3 S212539 [0,1,0,1,0,0|2,0,0]=4 50 B20R3.16123 O=C(OC1=CC2=C(C=CC=C2)C=C1)C3=CC=CO3 S197564 [1,0,0,0,1,0|1,0,0]=3 51 B20R3.34875 O=C(C1=CC=CC=C1)C2=CC3=C(C=CC=C3)C=C2 R752053 [1,0,0,0,1,0|0,0,0]=2