0 B14R2.8239 CC1=CC2=CC=C(N)C=C2NC1=O 1499898 [0,0,0,0,0,0|2,0,0]=2 1 B14R2.8239 CC1=CC=C2NC(=O)C(=O)NC2=C1 2128591 [0,0,0,0,0,0|2,0,1]=3 2 B14R2.8239 CC1OC2=CC=C(Cl)C=C2NC1=O 1258382 [0,0,0,0,0,0|2,1,1]=4 3 B14R2.8239 CC1OC2=CC=C(N)C=C2NC1=O 3585767 [0,0,0,0,0,0|3,0,1]=4 4 B14R2.8239 CC1OC2=CC=C(N)C=C2NC1=O 7020710126 [0,0,0,0,0,0|3,0,1]=4 5 B14R2.8239 NC1=CC2=C(C=C1)NC(=O)C(=O)N2 1903378 [0,0,0,0,0,0|2,0,1]=3 6 B14R2.8239 NC1=CC=C2N=C(O)C(O)=NC2=C1 15298262 [0,0,0,0,0,0|2,0,2]=4 7 B13R2.155 CC1=CC=C2C=CC(=O)OC2=C1 5662506 [1,0,0,0,0,0|2,0,0]=3 8 B13R2.155 CC1=CC=C2OCC(=O)NC2=C1 1258383 [1,0,0,0,0,0|2,0,1]=4 9 B13R2.155 NC1=CC2=C(C=C1)OCC(=O)N2 7020410398 [1,0,0,0,0,0|2,0,1]=4 10 B13R2.155 O=C1COC2=CC=C(Cl)C=C2N1 0128760740 [1,0,0,0,0,0|1,1,1]=4 11 B13R2.155 O=C1COC2=CC=C(O)C=C2N1 1526731 [1,0,0,0,0,0|2,0,1]=4 12 B13R2.369 CC1=CC2=C(C=CC=C2)N=C1Cl 7118560783 [1,0,0,0,0,0|2,0,1]=4 13 B13R2.369 CC1=CC2=CC=CC=C2NC1=O 2630813 [1,0,0,0,0,0|1,0,0]=2 14 B13R2.369 CC1OC2=C(C=CC=C2)NC1=O 7020240406 [1,0,0,0,0,0|2,0,1]=4 15 B13R2.369 NC1CC2=CC=CC=C2NC1=O 2048871 [1,0,0,0,0,0|1,0,2]=4 16 B13R2.369 O=C1NC2=CC=CC=C2NC1=O 2128590 [1,0,0,0,0,0|1,0,1]=3 17 B13R2.3683 OC1=CC2=C(C=C1)C=C(Br)C=C2 1259086 [1,0,0,0,0,0|1,1,0]=3 18 B15R2.1754 N#CC1=CC2=CC=C(F)C=C2OC1=O 5044295 [0,1,0,0,0,0|2,0,0]=3 19 B15R2.1754 O=CC1=CC2=CC=C(Br)C=C2NC1=O 7020691372 [0,1,0,0,0,0|0,1,1]=3 20 B15R2.1754 O=CC1=CC2=CC=C(Cl)C=C2NC1=O 7020691362 [0,1,0,0,0,0|0,1,1]=3 21 B15R2.1754 O=CC1=CC2=CC=C(F)C=C2N=C1Cl 1045290 [0,1,0,0,0,0|1,0,2]=4 22 B15R2.1824 O=CC1=CC2=CC(F)=CC=C2N=C1Cl 7020617821 [0,1,0,0,0,0|3,0,0]=4 23 B15R2.1824 O=CC1=CC2=CC(F)=CC=C2NC1=O 7020691360 [0,1,0,0,0,0|2,0,1]=4 24 B15R2.21336 COC1=CC=C2C=C(C)C(=O)NC2=C1 3463693 [0,1,0,0,0,0|2,0,0]=3 25 B15R2.62227 CC1=CC2=CC(C)=C(C)C=C2NC1=O 3463690 [0,1,0,0,0,0|2,0,0]=3 26 B15R2.63893 CC1=C(Br)C(=O)OC2=CC(O)=CC=C21 1106822 [0,1,0,0,0,0|3,0,0]=4 27 B15R2.63893 CC1=C(C)C2=CC=C(O)C=C2OC1=O 1090184 [0,1,0,0,0,0|3,0,0]=4 28 B15R2.63893 CC1=C(Cl)C(=O)OC2=C1C=CC(O)=C2 3020729 [0,1,0,0,0,0|3,0,0]=4 29 B15R2.63893 CC1=C(F)C(=O)OC2=CC(O)=CC=C21 3459785 [0,1,0,0,0,0|3,0,0]=4 30 B13R1.133 CC(=O)C(=O)CC1=CC=C(F)C=C1 5813859 [0,0,1,0,0,0|1,0,2]=4 31 B13R1.133 C\C(=C/C1=CC=C(Cl)C=C1)C(=O)O 1048354 [0,0,1,0,0,0|2,1,0]=4 32 B13R1.133 C\C(=C/C1=CC=C(F)C=C1)C(=O)O 1048347 [0,0,1,0,0,0|2,0,0]=3 33 B13R1.133 O=C(O)C(O)CC1=CC=C(F)C=C1 1368335 [0,0,1,0,0,0|1,0,2]=4 34 B13R1.133 O=C(O)\C(O)=C\C1=CC=C(F)C=C1 5980476 [0,0,1,0,0,0|1,0,0]=2 35 B13R1.148 CC(=O)C(=O)CC1=CC(F)=CC=C1 5813860 [0,0,1,0,0,0|1,0,2]=4 36 B13R2.3028 O=C1NC2=CC=C(Br)C=C2C1=O 1217764 [0,0,0,0,1,0|1,1,1]=4 37 B13R2.3028 O=C1NC2=CC=C(Cl)C=C2C1=O 7119850531 [0,0,0,0,1,0|1,1,1]=4 38 B12R1.21 CC1=CC=C(\C=C\C(=O)O)C=C1 7013891387 [1,0,1,0,0,0|2,0,0]=4 39 B12R1.21 NC(=O)\C=C\C1=CC=C(O)C=C1 2426235 [1,0,1,0,0,0|1,0,0]=3 40 B12R1.21 O=C(Cl)\C=C\C1=CC=C(F)C=C1 1375533 [1,0,1,0,0,0|1,0,0]=3 41 B12R1.21 O=C(O)\C=C\C1=CC=C(Br)C=C1 1512693 [1,0,1,0,0,0|1,1,0]=4 42 B12R1.21 O=C(O)\C=C\C1=CC=C(Cl)C=C1 0125160273 [1,0,1,0,0,0|1,1,0]=4 43 B12R1.21 O=C(O)\C=C\C1=CC=C(F)C=C1 0103940052 [1,0,1,0,0,0|1,0,0]=3 44 B12R1.21 O=[N+]([O-])\C=C\C1=CC=C(F)C=C1 22430461 [1,0,1,0,0,0|2,0,0]=4 45 B12R1.43 C\C(=C/C1=CC=CC=C1)C(=O)O 1048342 [1,0,1,0,0,0|2,0,0]=4 46 B12R1.43 O=C(O)C(=O)NC1=CC=CC=N1 1129961 [1,0,1,0,0,0|2,0,0]=4 47 B12R1.50 CC1=CC=CC(NC(=O)CO)=C1 1015596 [1,0,1,0,0,0|1,0,1]=4 48 B12R1.50 O=C(CO)NC1=CC(Cl)=CC=C1 1015638 [1,0,1,0,0,0|0,1,1]=4 49 B12R1.226 O=C(O)\C=C\C1=CC=CC(F)=C1 1512411 [1,0,1,0,0,0|2,0,0]=4 50 B12R2.24 CC1=CC2=C(C=CC=C2)C=C1 2827789 [2,0,0,0,0,0|2,0,0]=4 51 B12R2.24 CC1=NC2=C(C=CC=C2)C=C1 2827938 [2,0,0,0,0,0|1,0,1]=4 52 B12R2.24 FC1=CC2=CC=CC=C2C=C1 5011242 [2,0,0,0,0,0|1,0,0]=3 53 B12R2.24 O=C1C=CC2=C(C=CC=C2)O1 2828560 [2,0,0,0,0,0|1,0,0]=3 54 B12R2.24 O=C1C=NC2=CC=CC=C2N1 7020204758 [2,0,0,0,0,0|1,0,0]=3 55 B12R2.24 O=C1CCC2=CC=CC=C2N1 1655132 [2,0,0,0,0,0|0,0,2]=4 56 B12R2.24 O=C1CNC2=CC=CC=C2N1 0111910003 [2,0,0,0,0,0|1,0,1]=4 57 B12R2.24 O=C1COC2=CC=CC=C2N1 7020041238 [2,0,0,0,0,0|1,0,1]=4 58 B12R2.24 O=C1CSC2=C(C=CC=C2)N1 7119930006 [2,0,0,0,0,0|1,0,1]=4 59 B12R2.24 OC1=CC2=C(C=C1)N=CC=C2 2819404 [2,0,0,0,0,0|2,0,0]=4 60 B12R2.24 OC1=CC2=C(C=CC=C2)C=C1 2828139 [2,0,0,0,0,0|1,0,0]=3 61 B12R2.24 SC1=CC2=CC=CC=C2C=C1 1556415 [2,0,0,0,0,0|1,1,0]=4 62 B14R1.536 N#C\C(=C\C1=CC=C(Cl)C=C1)C(N)=O 2125405 [0,1,1,0,0,0|1,1,0]=4 63 B14R2.29365 CC1=CC(=O)NC2=CC(Br)=CC=C12 5946936 [1,1,0,0,0,0|0,1,0]=3 64 B14R2.29365 CC1=CC(=O)OC2=C1C=CC(O)=C2 7117171611 [1,1,0,0,0,0|2,0,0]=4 65 B14R2.1128 CCC1=CC2=CC=CC=C2NC1=O 22430484 [1,1,0,0,0,0|1,0,0]=3 66 B14R2.1128 N#CC1=CC2=CC=CC=C2NC1=O 7020691436 [1,1,0,0,0,0|1,0,0]=3 67 B14R2.1128 NCC1=CC2=CC=CC=C2NC1=O 1048787 [1,1,0,0,0,0|1,0,0]=3 68 B14R2.1128 O=CC1=CC2=CC=CC=C2NC1=O 7020691350 [1,1,0,0,0,0|0,0,1]=3 69 B14R2.8188 CC1=CC2=CC=CC=C2N(C)C1=O 7571174 [1,1,0,0,0,0|1,0,0]=3 70 B14R2.19008 CC1=C(C=O)C2=CC(F)=CC=C2N1 1200639 [0,1,0,0,1,0|2,0,0]=4 71 B14R2.19008 O=CC1=C(Cl)NC2=CC=C(F)C=C21 1034078 [0,1,0,0,1,0|2,0,0]=4 72 B14R2.1815 COC1=CC=C2C(=O)C(=O)NC2=C1 7020542475 [0,1,0,0,1,0|1,0,1]=4 73 B16R2.6501 CC1=CC=C2C=C(CCN)C(=O)NC2=C1 1048834 [0,2,0,0,0,0|2,0,0]=4 74 B16R2.6501 NCCC1=CC2=CC=C(F)C=C2NC1=O 1048841 [0,2,0,0,0,0|1,0,0]=3 75 B16R2.23520 O=C(O)C1=CC2=CC=C(Br)C=C2NC1=O 7020691415 [0,2,0,0,0,0|0,1,0]=3 76 B16R2.23520 O=C(O)C1=CC2=CC=C(F)C=C2N=C1Cl 1049801 [0,2,0,0,0,0|1,0,1]=4 77 B16R2.23520 O=C(O)C1=CC2=CC=C(F)C=C2NC1=O 7020691402 [0,2,0,0,0,0|0,0,0]=2 78 B16R2.23520 O=C(O)C1=CC2=CC=C(O)C=C2OC1=O 7015592710 [0,2,0,0,0,0|2,0,0]=4 79 B16R2.41208 N#CC1=CC2=C(C=C(F)C=C2F)OC1=O 5044296 [0,2,0,0,0,0|2,0,0]=4 80 B16R2.192946 CC1=C(C)C=C2NC(=O)C(C=O)=CC2=C1 7020691356 [0,2,0,0,0,0|1,0,1]=4 81 B16R2.192946 CC1=C(C)C=C2NC(=O)C(CN)=CC2=C1 1048793 [0,2,0,0,0,0|2,0,0]=4 82 B16R2.192946 CC1=C(C)C=C2NC(=O)C(CO)=CC2=C1 1085636 [0,2,0,0,0,0|1,0,0]=3 83 B14R2.4529 CC1=CC=C2C=C(C(=O)O)OC2=C1 1178906 [0,0,1,1,0,0|2,0,0]=4 84 B14R2.4529 O=C(O)C1=CC2=CC=C(Br)C=C2O1 3929822 [0,0,1,1,0,0|1,1,0]=4 85 B12R1.20 CC(=O)C(=O)C1=CC=C(F)C=C1 1973666 [0,0,1,0,1,0|1,0,1]=4 86 B12R2.606 NC1=CC2=C(C=C1)NC(=O)N2 2204842 [1,0,0,0,1,0|2,0,0]=4 87 B12R2.606 NC1=CC=C2OC(=O)NC2=C1 1047623 [1,0,0,0,1,0|2,0,0]=4 88 B12R2.18 CC1=C(Br)C2=CC=CC=C2N1 1361130 [1,0,0,0,1,0|2,0,0]=4 89 B12R2.18 CC1=C(I)C2=CC=CC=C2N1 1361959 [1,0,0,0,1,0|2,0,0]=4 90 B12R2.18 CC1C(=O)NC2=C1C=CC=C2 4247509 [1,0,0,0,1,0|1,0,1]=4 91 B12R2.18 CN1C(=O)NC2=C1C=CC=C2 1435637 [1,0,0,0,1,0|2,0,0]=4 92 B12R2.18 NC1C(=O)NC2=C1C=CC=C2 6850887 [1,0,0,0,1,0|1,0,1]=4 93 B12R2.18 O=C1NC2=CC=CC=C2C1=O 2828769 [1,0,0,0,1,0|0,0,1]=3