0 B22R3.10622968 CC1=CC=C2N=C(C(N=C(C2=C1)C3=CC=CC=C3)O)O MCULE-8357991876 [0,0,0,0,0,0|1,0,2]=3 1 B22R3.10622968 CC1N=C(C2=CC(=CC=C2NC1=O)Cl)C3=CC=CC=C3 MCULE-8265134717 [0,0,0,0,0,0|1,0,0]=1 2 B22R3.10622968 NC1=NC(=C2C=C(C=CC2=NC1=O)Cl)C3=CC=CC=C3 MCULE-5521488854 [0,0,0,0,0,0|1,0,2]=3 3 B22R3.10622968 NC1N=C(C2=C(C=CC(=C2)Br)NC1=O)C3=CC=CC=C3 MCULE-4155756197 [0,0,0,0,0,0|1,1,0]=2 4 B22R3.10622968 NC1N=C(C2=C(C=CC(=C2)Cl)NC1=O)C3=CC=CC=C3 MCULE-5212167722 [0,0,0,0,0,0|1,0,0]=1 5 B22R3.10622968 O=C1NC2=C(C=C(C=C2)Cl)C(=NC1O)C3=CC=CC=C3 MCULE-9052741554 [0,0,0,0,0,0|0,0,0]=0 6 B22R3.10622968 O=C1NC2=CC=C(C=C2C(=NC1O)C3=CC=CC=C3)Br MCULE-4077497717 [0,0,0,0,0,0|0,1,0]=1 7 B22R3.10622968 O=C1NC2=CC=C(C=C2C(NC1=O)C3=CC=CC=C3)Cl MCULE-2667364674 [0,0,0,0,0,0|0,0,4]=4 8 B21R3.157575 CC1=CC2=C(C=C1)NC(=O)CN=C2C3=CC=CC=C3 MCULE-5803043183 [1,0,0,0,0,0|1,0,0]=2 9 B21R3.157575 CC1=CC2=C(C=C1)NC(=O)CNC2C3=CC=CC=C3 MCULE-2258530594 [1,0,0,0,0,0|1,0,2]=4 10 B21R3.157575 NC1=CC2=C(C=C1)NC(=O)CNC2C3=CC=CC=C3 MCULE-5789159429 [1,0,0,0,0,0|1,0,2]=4 11 B21R3.157575 NC1=CC=C2NC(=O)CN=C(C2=C1)C3=CC=CC=C3 MCULE-5421679366 [1,0,0,0,0,0|1,0,0]=2 12 B21R3.157575 NC1=NC2=CC=C(C=C2C(=NC1)C3=CC=CC=C3)Cl MCULE-3731089663 [1,0,0,0,0,0|1,0,1]=3 13 B21R3.157575 O=C1CN=C(C2=C(N1)C=CC(=C2)Br)C3=CC=CC=C3 MCULE-9455844546 [1,0,0,0,0,0|0,1,0]=2 14 B21R3.157575 O=C1CNC(C2=CC(=CC=C2N1)Br)C3=CC=CC=C3 MCULE-4096196112 [1,0,0,0,0,0|0,1,2]=4 15 B21R3.157575 O=C1CSC(C2=C(N1)C=CC(=C2)Cl)C3=CC=CC=C3 MCULE-5938873622 [1,0,0,0,0,0|1,0,1]=3 16 B21R3.157575 OC1=NC2=C(C=C(C=C2)Cl)C(=NC1)C3=CC=CC=C3 MCULE-2705262252 [1,0,0,0,0,0|0,0,2]=3 17 B21R3.157575 S=C1CN=C(C2=C(N1)C=CC(=C2)Cl)C3=CC=CC=C3 MCULE-9360651547 [1,0,0,0,0,0|0,1,0]=2 18 B21R3.413840 NC1=NC(=C2C=CC=CC2=NC1=O)C3=CC=CC=C3 MCULE-9595211302 [1,0,0,0,0,0|1,0,2]=4 19 B21R3.413840 NC1N=C(C2=CC=CC=C2NC1=O)C3=CC=CC=C3 MCULE-6765475818 [1,0,0,0,0,0|1,0,0]=2 20 B21R3.413840 N[C@H]1N=C(C2=CC=CC=C2NC1=O)C3=CC=CC=C3 MCULE-3078612824 [1,0,0,0,0,0|1,0,0]=2 21 B21R3.413840 OC1=NC2=CC=CC=C2C(=NC1O)C3=CC=CC=C3 MCULE-3188511601 [1,0,0,0,0,0|0,0,2]=3 22 B23R3.16441448 C[C@@H]1N=C(C2=CC(=CC=C2NC1=O)Br)C3=CC=CC=C3F MCULE-4288102339 [0,1,0,0,0,0|1,1,0]=3 23 B23R3.16441448 O=C1NC2=C(C=C(C=C2)Br)C(=NC1O)C3=CC=CC=C3Cl MCULE-3436851686 [0,1,0,0,0,0|0,1,0]=2 24 B23R3.16441448 O=C1NC2=C(C=C(C=C2)Cl)C(=N[C@H]1O)C3=CC=CC=C3Cl MCULE-8083826442 [0,1,0,0,0,0|0,0,0]=1 25 B23R3.16441448 O=C1NC2=CC=C(N=C2C(=NC1O)C3=CC=CC=C3Cl)Cl MCULE-2075032615 [0,1,0,0,0,0|1,0,0]=2 26 B23R3.184486594 OC1=NC2=CC=C(C=C2C(=NC1O)C3=CC=C(C=C3)Cl)Br MCULE-6925489128 [0,1,0,0,0,0|0,1,2]=4 27 B21R2.4531 CC(SCC1=CC=CC=C1)C(=O)NC2=CC=C(C=C2)Cl MCULE-8457678343 [0,0,1,0,0,0|2,0,1]=4 28 B21R2.507331 C=CC(=O)NC1=C(C=C(C=C1)Cl)C(=O)C2=CC=CC=C2 MCULE-5594729682 [0,0,1,0,0,0|2,0,1]=4 29 B21R2.507331 CCC(=O)NC1=CC=C(C=C1C(=O)C2=CC=CC=C2)Cl MCULE-6190810928 [0,0,1,0,0,0|2,0,0]=3 30 B21R2.507331 NCC(=O)NC1=C(C=C(C=C1)Br)C(=O)C2=CC=CC=C2 MCULE-1252538733 [0,0,1,0,0,0|2,1,0]=4 31 B21R2.507331 NCC(=O)NC1=C(C=C(C=C1)Br)C(=O)C2=CC=CC=C2 MCULE-1732399902 [0,0,1,0,0,0|2,1,0]=4 32 B21R2.507331 O=C(CBr)NC1=CC=C(C=C1C(=O)C2=CC=CC=C2)Br MCULE-2180104478 [0,0,1,0,0,0|2,1,0]=4 33 B21R2.507331 O=C(CBr)NC1=CC=C(C=C1C(=O)C2=CC=CC=C2)Cl MCULE-5904647104 [0,0,1,0,0,0|2,0,0]=3 34 B21R2.507331 O=C(CCl)NC1=CC=C(C=C1C(=O)C2=CC=CC=C2)Cl MCULE-8785830102 [0,0,1,0,0,0|2,0,0]=3 35 B21R3.420045 NC1=C(C2=C(C=CC(=C2)Br)NC1=O)C3=CC=CC=C3 MCULE-3079713923 [0,0,0,0,1,0|1,1,1]=4 36 B20R2.15829 O=C(CC1=CC=C(C=C1)Cl)NN=CC2=CC=CC=C2 MCULE-2772177478 [1,0,1,0,0,0|2,0,0]=4 37 B20R2.15829 O=C(CCCC1=CC=CC=C1)NC2=CC=C(C=C2)Cl MCULE-8436061322 [1,0,1,0,0,0|1,0,1]=4 38 B20R2.15829 O=C(CNCC1=CC=CC=C1)NC2=CC=C(C=C2)Cl MCULE-3436332501 [1,0,1,0,0,0|0,0,2]=4 39 B20R2.15829 O=C(CSCC1=CC=CC=C1)NC2=CC=C(C=C2)Cl MCULE-8114766870 [1,0,1,0,0,0|1,0,1]=4 40 B20R2.15829 O=C(NC1=CC=C(C=C1)Cl)ON=CC2=CC=CC=C2 MCULE-8805236058 [1,0,1,0,0,0|1,0,0]=3 41 B20R2.15829 O=C(NC=CC1=CC=CC=C1)NC2=CC=C(C=C2)Cl MCULE-8503837711 [1,0,1,0,0,0|2,0,0]=4 42 B20R2.184888 O=CNC1=CC=C(C=C1C(=NO)C2=CC=CC=C2)Cl MCULE-6577163992 [1,0,1,0,0,0|0,0,0]=2 43 B20R2.27400 CCC(=O)NC1=C(C=CC=C1)C(=O)C2=CC=CC=C2 MCULE-8802870406 [1,0,1,0,0,0|2,0,0]=4 44 B20R2.27400 O=C(CBr)NC1=CC=CC=C1C(=O)C2=CC=CC=C2 MCULE-4362075337 [1,0,1,0,0,0|2,0,0]=4 45 B20R2.27400 O=C(CCl)NC1=C(C=CC=C1)C(=O)C2=CC=CC=C2 MCULE-1494825065 [1,0,1,0,0,0|2,0,0]=4 46 B20R2.156004 CC(=O)NC1=C(C=C(C=C1)Br)C(=O)C2=CC=CC=C2 MCULE-7108724047 [1,0,1,0,0,0|1,1,0]=4 47 B20R2.156004 CC(=O)NC1=CC=C(C=C1C(=O)C2=CC=CC=C2)C MCULE-1844718609 [1,0,1,0,0,0|2,0,0]=4 48 B20R2.156004 CC(=O)NC1=CC=C(C=C1C(=O)C2=CC=CC=C2)Cl MCULE-5649227681 [1,0,1,0,0,0|1,0,0]=3 49 B20R3.5687 O=C1CN=C(C2=C(N1)C=CC=C2)C3=CC=CC=C3 MCULE-2013823654 [2,0,0,0,0,0|0,0,0]=2 50 B20R3.5687 O=C1CNC(C2=C(N1)C=CC=C2)C3=CC=CC=C3 MCULE-1948771741 [2,0,0,0,0,0|0,0,2]=4 51 B20R3.5687 O=C1CNC(C2=CC=CC=C2N1)C3=CC=CC=C3 MCULE-6130721401 [2,0,0,0,0,0|0,0,2]=4 52 B20R3.5687 O=C1CN[C@@H](C2=CC=CC=C2N1)C3=CC=CC=C3 MCULE-6520775266 [2,0,0,0,0,0|0,0,2]=4 53 B20R3.5687 O=C1CN[C@@H](C2=CC=CC=C2N1)C3=CC=CC=C3 MCULE-8335042512 [2,0,0,0,0,0|0,0,2]=4 54 B22R2.308557 CC(Br)C(=O)NC1=CC=C(C=C1C(=O)C2=CC=CC=C2)Cl MCULE-3525095895 [0,1,1,0,0,0|2,0,0]=4 55 B22R2.308557 CC(C)C(=O)NC1=C(C=C(C=C1)Cl)C(=O)C2=CC=CC=C2 MCULE-1212640233 [0,1,1,0,0,0|2,0,0]=4 56 B22R2.308557 O=C(C1=CC=CC=C1)C2=C(C=CC(=C2)Cl)NC(=O)C(Cl)Cl MCULE-7088250287 [0,1,1,0,0,0|2,0,0]=4 57 B22R2.398685 CCCC(=O)NC1=CC=C(C=C1C(=O)C2=CC=CC=C2)Cl MCULE-6395345497 [0,1,1,0,0,0|2,0,0]=4 58 B22R2.398685 CCOC(=O)NC1=CC=C(C=C1C(=O)C2=CC=CC=C2)Cl MCULE-9493815617 [0,1,1,0,0,0|2,0,0]=4 59 B22R2.398685 COCC(=O)NC1=C(C=C(C=C1)Cl)C(=O)C2=CC=CC=C2 MCULE-6225306156 [0,1,1,0,0,0|1,0,0]=3 60 B22R2.398685 O=C(CCCl)NC1=CC=C(C=C1C(=O)C2=CC=CC=C2)Cl MCULE-2972507314 [0,1,1,0,0,0|2,0,0]=4 61 B22R2.734691 CN(C(=O)CCl)C1=C(C=C(C=C1)Cl)C(=O)C2=CC=CC=C2 MCULE-8837791438 [0,1,1,0,0,0|2,0,0]=4 62 B22R2.2374901 O=C(CBr)NC1=C(C=C(C=C1)Cl)C(=O)C2=C(C=CC=C2)Cl MCULE-9877013826 [0,1,1,0,0,0|2,0,0]=4 63 B22R2.2374901 O=C(CBr)NC1=CC=C(C=C1C(=O)C2=CC=CC=C2F)Cl MCULE-7393517749 [0,1,1,0,0,0|2,0,0]=4 64 B22R2.2374901 O=C(CCl)NC1=C(C=C(C=C1)Cl)C(=O)C2=C(C=CC=C2)F MCULE-7777972202 [0,1,1,0,0,0|2,0,0]=4 65 B22R2.2374901 O=C(CCl)NC1=CC=C(C=C1C(=O)C2=C(C=CC=C2)Cl)Cl MCULE-2300728889 [0,1,1,0,0,0|2,0,0]=4 66 B22R2.2802135 O=C(CCl)NC1=CC=C(C=C1/C(=N/O)/C2=CC=CC=C2)Cl MCULE-8055535830 [0,1,1,0,0,0|1,0,0]=3 67 B22R3.118192 CNC1=NC2=C(C=C(C=C2)Cl)C(=NC1)C3=CC=CC=C3 MCULE-2342758983 [1,1,0,0,0,0|1,0,1]=4 68 B22R3.118192 NNC1=NC2=CC=C(C=C2C(=NC1)C3=CC=CC=C3)Cl MCULE-4396936055 [1,1,0,0,0,0|1,0,1]=4 69 B22R3.5616688 CC1=CC=CC=C1C2=NCC(=S)NC3=C2C=C(C=C3)Cl MCULE-9936375203 [1,1,0,0,0,0|0,1,0]=3 70 B22R3.5616688 NC1=CC2=C(C=C1)NC(=O)CN=C2C3=CC=CC=C3Cl MCULE-6686856579 [1,1,0,0,0,0|1,0,0]=3 71 B22R3.5616688 O=C1CN=C(C2=C(N1)C=CC(=C2)Br)C3=C(C=CC=C3)F MCULE-9080855252 [1,1,0,0,0,0|0,1,0]=3 72 B22R3.5616688 O=C1CN=C(C2=C(N1)C=CC(=C2)Br)C3=CC=CC=C3Br MCULE-6677159932 [1,1,0,0,0,0|0,1,0]=3 73 B22R3.5616688 O=C1CN=C(C2=C(N1)C=CC(=C2)Br)C3=CC=CC=C3Cl MCULE-5571390807 [1,1,0,0,0,0|0,1,0]=3 74 B22R3.5616688 O=C1CN=C(C2=C(N1)C=CC(=C2)Cl)C3=CC=CC=C3Br MCULE-9416771172 [1,1,0,0,0,0|0,0,0]=2 75 B22R3.5616688 O=C1CN=C(C2=CC(=CC=C2N1)Cl)C3=C(C=CC=C3)Cl MCULE-8414231364 [1,1,0,0,0,0|0,0,0]=2 76 B22R3.5616688 O=C1CN=C(C2=CC(=CC=C2N1)Cl)C3=CC=CC=C3F MCULE-2228120601 [1,1,0,0,0,0|0,0,0]=2 77 B22R3.5616688 O=C1CNC(C2=C(N1)C=CC(=C2)Cl)C3=C(C=CC=C3)F MCULE-2373670307 [1,1,0,0,0,0|0,0,2]=4 78 B22R3.5616688 O=C1CSC(C2=CC(=CC=C2N1)Cl)C3=C(C=CC=C3)Cl MCULE-4811719958 [1,1,0,0,0,0|1,0,1]=4 79 B22R3.5616688 S=C1CN=C(C2=C(N1)C=CC(=C2)Cl)C3=C(C=CC=C3)Cl MCULE-2292511410 [1,1,0,0,0,0|0,1,0]=3 80 B22R3.11094439 CN1C(=O)CN=C(C2=C1C=CC(=C2)Br)C3=CC=CC=C3 MCULE-5564863148 [1,1,0,0,0,0|0,1,0]=3 81 B22R3.11094439 CN1C(=O)CN=C(C2=C1C=CC(=C2)Cl)C3=CC=CC=C3 MCULE-8990989144 [1,1,0,0,0,0|0,0,0]=2 82 B22R3.11094439 CN1C(=O)CN=C(C2=C1C=CC(=C2)N)C3=CC=CC=C3 MCULE-4642357297 [1,1,0,0,0,0|1,0,0]=3 83 B22R3.11094439 CN1C(=S)CN=C(C2=C1C=CC(=C2)Cl)C3=CC=CC=C3 MCULE-4872259336 [1,1,0,0,0,0|0,1,0]=3 84 B22R3.41037317 CC1=CC2=C(C=C1)NC(=O)CN=C2C3=CC=C(C=C3)F MCULE-1890255786 [1,1,0,0,0,0|1,0,0]=3 85 B22R3.41037317 CC1=CC=C(C=C1)C2=NCC(=O)NC3=C2C=C(C=C3)Br MCULE-7043272719 [1,1,0,0,0,0|0,1,0]=3 86 B22R3.41037317 O=C1CN=C(C2=C(N1)C=CC(=C2)Br)C3=CC=C(C=C3)Br MCULE-4993441180 [1,1,0,0,0,0|0,1,0]=3 87 B22R3.41037317 O=C1CN=C(C2=C(N1)C=CC(=C2)Br)C3=CC=C(C=C3)F MCULE-8649479021 [1,1,0,0,0,0|0,1,0]=3 88 B22R3.41037317 O=C1CN=C(C2=C(N1)C=CC(=C2)F)C3=CC=C(C=C3)F MCULE-8328761118 [1,1,0,0,0,0|0,1,0]=3 89 B22R3.41037317 O=C1CN=C(C2=CC(=CC=C2N1)Cl)C3=CC=C(C=C3)F MCULE-9300473778 [1,1,0,0,0,0|0,0,0]=2 90 B22R3.41727004 O=C1CN=C(C2=C(N1)C=CC(=C2)Br)C3=CC(=CC=C3)Cl MCULE-5664861226 [1,1,0,0,0,0|0,1,0]=3 91 B22R3.41727004 O=C1CN=C(C2=C(N1)C=CC(=C2)Br)C3=CC=CC(=C3)Br MCULE-8620448811 [1,1,0,0,0,0|0,1,0]=3 92 B22R3.41727004 O=C1CN=C(C2=C(N1)C=CC(=C2)Cl)C3=CC=CC(=C3)Br MCULE-3414106768 [1,1,0,0,0,0|0,0,0]=2 93 B22R3.5439878 NC1N=C(C2=CC=CC=C2NC1=O)C3=CC=CC(=C3)F MCULE-7933022463 [1,1,0,0,0,0|1,0,0]=3 94 B22R3.7265977 CN1C(=O)C(N=C(C2=C1C=CC=C2)C3=CC=CC=C3)N MCULE-7532569137 [1,1,0,0,0,0|1,0,0]=3 95 B22R3.7265977 CN1C(=O)C(N=C(C2=CC=CC=C12)C3=CC=CC=C3)O MCULE-4118403508 [1,1,0,0,0,0|0,0,0]=2 96 B22R3.10424210 NC1N=C(C2=CC=CC(=C2NC1=O)F)C3=CC=CC=C3 MCULE-4306673553 [1,1,0,0,0,0|1,0,0]=3 97 B22R3.10424210 N[C@@H]1N=C(C2=CC=CC(=C2NC1=O)F)C3=CC=CC=C3 MCULE-3242644603 [1,1,0,0,0,0|1,0,0]=3 98 B22R3.46836 O=C(NC1=CC=C(C=C1)Cl)C2COC3=C(O2)C=CC=C3 MCULE-2380803205 [0,0,1,1,0,0|2,0,0]=4 99 B22R4.12410134 O=C1NC2=CC=C(C=C2C3=C1SC4=C3C=CC=C4)Cl MCULE-4645617427 [0,0,0,1,1,0|0,1,1]=4 100 B20R2.4447 CC(CC1=CC=CC=C1)C(=O)NC2=CC=C(C=C2)Cl MCULE-3886881759 [0,0,1,0,1,0|1,0,1]=4 101 B20R2.4447 CC(OC1=CC=CC=C1)C(=O)NC2=CC=C(C=C2)Cl MCULE-9707079380 [0,0,1,0,1,0|2,0,0]=4 102 B20R2.4447 CC(SC1=CC=CC=C1)C(=O)NC2=CC=C(C=C2)Cl MCULE-6720815599 [0,0,1,0,1,0|2,0,0]=4 103 B20R2.4447 O=C(NC1=CC=C(C=C1)Cl)C(=CC2=CC=CC=C2)Cl MCULE-8388378396 [0,0,1,0,1,0|1,0,1]=4 104 B20R2.248185 O=C(CCl)C1=C(C=C(C=C1)Cl)C(=O)C2=CC=CC=C2 MCULE-3040456724 [0,0,1,0,1,0|2,0,0]=4 105 B20R3.145206 O=C1N=C(C2=C(N1)C=CC(=C2)Cl)C3=CC=CC=C3 MCULE-9678158236 [1,0,0,0,1,0|0,0,2]=4 106 B20R3.95897 O=C1CN=C(C2=CC(=CC=C2N1)Cl)C3=CC=CN3 MCULE-3371968433 [1,0,0,0,1,0|1,0,0]=3 107 B20R3.95897 O=C1CN=C(C2=CC(=CC=C2N1)F)C3=CC=CN3 MCULE-4727897306 [1,0,0,0,1,0|1,1,0]=4 108 B20R3.242177 CN1N=C(C2=CC=CC=C2C1=O)C3=CC=CC=C3 MCULE-4031995040 [1,0,0,0,1,0|2,0,0]=4 109 B20R3.268985 O=C1NC2=CC=CC=C2C(=C1O)C3=CC=CC=C3 MCULE-8852053118 [1,0,0,0,1,0|0,0,1]=3