0 B14R2.203 CC1=C(C#N)C2=C(C=CC=C2)C=N1 4401439 [0,0,0,0,0,0|2,0,2]=4 1 B14R2.203 O=CC1=C(O)C=CC2=CC=CC=C21 2129573 [0,0,0,0,0,0|1,0,1]=2 2 B13R2.32 NC1=C(Br)C2=CC=CC=C2C=C1 3358330 [1,0,0,0,0,0|2,0,0]=3 3 B13R2.32 O=C1C=CC2=C(C=CC=C2)C1=O 2821948 [1,0,0,0,0,0|1,0,1]=3 4 B13R2.1613 ClCC1=CC=CC2=CC=CC=C21 2083808 [1,0,0,0,0,0|1,0,0]=2 5 B13R2.1613 N#CC1=CC=CC2=CC=CC=C12 1507829 [1,0,0,0,0,0|0,0,2]=3 6 B13R2.1613 NNC1=NC=NC2=CC=CC=C21 7010010204 [1,0,0,0,0,0|3,0,0]=4 7 B13R2.1613 O=CC1=CC=CC2=CC=CC=C12 2083827 [1,0,0,0,0,0|1,0,1]=3 8 B15R2.1162 CC1=C(C(=O)O)C2=CC=CC=C2C=C1 1509903 [0,1,0,0,0,0|2,0,1]=4 9 B15R2.1162 O=C(O)C1=C(O)C=CC2=CC=CC=C21 1262439 [0,1,0,0,0,0|1,0,1]=3 10 B15R2.2115 COC1=CC=C2C=CC=CC2=C1C=O 7020401742 [0,1,0,0,0,0|1,0,1]=3 11 B15R2.5773 O=CC1=C2C=CC(Br)=CC2=CC=C1O 7018801968 [0,1,0,0,0,0|1,0,1]=3 12 B15R2.6124 CCN1C(=O)C=C(O)C2=C1C=CC=C2 9080279 [0,1,0,0,0,0|2,0,1]=4 13 B13R1.42 CCOC(=O)\C=C\C1=CC=CC=C1 22430693 [0,0,1,0,0,0|2,0,1]=4 14 B13R2.135 CC1=C(CN)N2C=CC=CC2=N1 1038055 [0,0,0,0,1,0|3,0,0]=4 15 B12R1.27 COC(=O)\C=C\C1=CC=CC=C1 11186114 [1,0,1,0,0,0|1,0,1]=4 16 B12R2.24 BrC1=CC=C2N=CC=CC2=C1 1361118 [2,0,0,0,0,0|2,0,0]=4 17 B12R2.24 BrC1=CC=C2N=CC=CC2=C1 6871429 [2,0,0,0,0,0|2,0,0]=4 18 B12R2.24 CC1=CC2=C(C=CC=C2)C=C1 2827789 [2,0,0,0,0,0|1,0,0]=3 19 B12R2.24 CC1=NC2=C(C=CC=C2)C=C1 2827938 [2,0,0,0,0,0|2,0,0]=4 20 B12R2.24 FC1=CC2=CC=CC=C2C=C1 5011242 [2,0,0,0,0,0|1,0,0]=3 21 B12R2.24 O=C1C=CC2=C(C=CC=C2)O1 2828560 [2,0,0,0,0,0|1,0,1]=4 22 B12R2.24 OC1=CC2=C(C=C1)N=CC=C2 2819404 [2,0,0,0,0,0|1,0,0]=3 23 B12R2.24 OC1=CC2=C(C=CC=C2)C=C1 2828139 [2,0,0,0,0,0|0,0,0]=2 24 B12R2.24 SC1=CC2=CC=CC=C2C=C1 1556415 [2,0,0,0,0,0|0,1,0]=3 25 B12R2.1081 BrC1=CC=CC2=CN=CC=C12 7213750057 [2,0,0,0,0,0|2,0,0]=4 26 B12R2.1081 BrC1=CN=CC2=CC=CC=C12 4005684 [2,0,0,0,0,0|2,0,0]=4 27 B12R2.1081 CC1=C2C=CC=CC2=NC=C1 2827940 [2,0,0,0,0,0|1,0,0]=3 28 B12R2.1081 CC1=C2N=CC=CC2=CC=C1 2827942 [2,0,0,0,0,0|1,0,0]=3 29 B12R2.1081 ClC1=C2C=CC=CC2=NC=C1 2823586 [2,0,0,0,0,0|2,0,0]=4 30 B12R2.1081 NC1=C2C=CC=CC2=NC=N1 2212834 [2,0,0,0,0,0|2,0,0]=4 31 B12R2.1081 NC1=CC=CC2=CC=CC=C12 1507828 [2,0,0,0,0,0|0,0,0]=2 32 B12R2.1081 NC1=CC=CC2=CC=CN=C12 1232989 [2,0,0,0,0,0|1,0,0]=3 33 B12R2.1081 NC1=NC=CC2=CC=CC=C21 1055516 [2,0,0,0,0,0|1,0,0]=3 34 B12R2.1081 O=C1C=CNC2=CC=CC=C12 3644587 [2,0,0,0,0,0|2,0,0]=4 35 B12R2.1081 O=C1NC=CC2=CC=CC=C12 1522001 [2,0,0,0,0,0|2,0,0]=4 36 B12R2.1081 OC1=C2C=CC=CC2=NC=C1 2819403 [2,0,0,0,0,0|2,0,0]=4 37 B12R2.1081 OC1=C2N=CC=CC2=CC=C1 2828333 [2,0,0,0,0,0|2,0,0]=4 38 B12R2.1081 OC1=CC=CC2=CC=CC=C12 1507830 [2,0,0,0,0,0|1,0,0]=3 39 B14R2.7724 CN1C(=O)C=C(O)C2=CC=CC=C21 2193680 [1,1,0,0,0,0|1,0,1]=4 40 B14R2.8188 CC1=CC2=CC=CC=C2N(C)C1=O 7571174 [1,1,0,0,0,0|1,0,1]=4 41 B14R2.1146 CC1=NC2=C(C=CC=C2)C(CO)=C1 2659358 [1,1,0,0,0,0|2,0,0]=4 42 B14R2.1146 NCC1=CC(=O)NC2=CC=CC=C12 1198887 [1,1,0,0,0,0|1,0,0]=3 43 B14R2.1146 NNC1=CC(=O)OC2=C1C=CC=C2 7110952632 [1,1,0,0,0,0|2,0,0]=4 44 B14R2.1146 O=C1C=C(CBr)C2=CC=CC=C2N1 1034037 [1,1,0,0,0,0|2,0,0]=4 45 B14R2.7150 CNCC1=C2C=CC=CC2=CC=C1 2992588 [1,1,0,0,0,0|0,0,0]=2 46 B14R2.7150 S=C=NC1=C2C=CC=CC2=CC=C1 2927729 [1,1,0,0,0,0|1,0,1]=4 47 B14R2.31359 CC(=O)C1=CC=CC2=CC=CC=C21 1312959 [1,1,0,0,0,0|1,0,1]=4 48 B14R2.31359 NC(=O)C1=CN=CC2=C1C=CC=C2 4388583 [1,1,0,0,0,0|1,0,1]=4 49 B14R2.31359 NC(=S)C1=C2C=CC=CC2=CC=C1 7020331326 [1,1,0,0,0,0|0,0,1]=3 50 B14R2.31359 O=C(O)C1=C2C=CC=CC2=CC=C1 7210540007 [1,1,0,0,0,0|1,0,1]=4 51 B14R2.517 CC1=CC2=C(C=CC=C2)N1CCN 15298396 [0,1,0,0,1,0|2,0,0]=4 52 B16R2.28256 CCOC1=CC=C2C=CC=CC2=C1C=O 7014792364 [0,2,0,0,0,0|1,0,1]=4 53 B16R2.333 CN(C)CC1=C2C=CC=CC2=CC=C1O 7011110183 [0,2,0,0,0,0|0,0,0]=2 54 B16R2.333 O=C(O)CC1=C2C=CC=CC2=CC=C1O 3357412 [0,2,0,0,0,0|1,0,0]=3 55 B14R2.24 OC1=CC=CC=C1C2=CC=CC=C2 1365416 [0,0,1,1,0,0|1,0,1]=4 56 B14R2.95 C=CC(=O)C1=CNC2=C1C=CC=C2 3355980 [0,0,1,1,0,0|0,0,2]=4 57 B12R2.18 CC1=CC2=CC=CC=C2N1C 3458594 [1,0,0,0,1,0|2,0,0]=4 58 B12R2.1 NCC1=CNC2=CC=CC=C12 7020690230 [1,0,0,0,1,0|1,0,0]=3 59 B12R2.1 NCC1=NC=C2C=CC=CN21 1143980 [1,0,0,0,1,0|2,0,0]=4