0 B23R3.10324912 CN(C)CC/C=C\1/C2=C(C=CC=C2)SC3=C1C=C(C=C3)Cl MCULE-8112602039 [0,0,0,0,0,0|1,0,1]=2 1 B23R3.10324912 CN(C)CC/C=C\1/C2=CC=CC=C2SC3=C1C=C(C=C3)Cl MCULE-7149047798 [0,0,0,0,0,0|1,0,1]=2 2 B23R3.10324912 CN(C)CCC=C1C2=CC=CC=C2SC3=C1C=C(C=C3)Cl MCULE-4912229237 [0,0,0,0,0,0|1,0,1]=2 3 B23R3.10324912 CN(C)CCC=C1C2=CC=CC=C2SC3=C1C=C(C=C3)Cl MCULE-7221241811 [0,0,0,0,0,0|1,0,1]=2 4 B23R3.10324912 CN(C)CCCC1C2=CC(=CC=C2NC3=C1C=CC=C3)Cl MCULE-2714985119 [0,0,0,0,0,0|2,0,0]=2 5 B23R3.10324912 CN(C)CCCN1C2=C(C=CC=C2)OC3=C1C=C(N=N3)Cl MCULE-3702076708 [0,0,0,0,0,0|2,1,0]=3 6 B23R3.10324912 CN(C)CCCN1C2=C(C=CC=C2)OC3=C1C=C(N=N3)Cl MCULE-7365891690 [0,0,0,0,0,0|2,1,0]=3 7 B23R3.10324912 CN(C)CCCN1C2=C(C=CC=C2)SC3=C1C=C(C=C3)Cl MCULE-5976054678 [0,0,0,0,0,0|0,0,0]=0 8 B23R3.10324912 CN(C)CCCN1C2=C(C=CC=C2)SC3=C1C=C(C=C3)Cl MCULE-8792081568 [0,0,0,0,0,0|0,0,0]=0 9 B23R3.10324912 CN(C)CCCN1C2=CC(=CC=C2SC3=C1C=CC=C3)Br MCULE-6965276497 [0,0,0,0,0,0|0,1,0]=1 10 B23R3.10324912 CN(C)CCCN1C2=CC(=CC=C2SC3=C1C=CC=C3)Br MCULE-9356559118 [0,0,0,0,0,0|0,1,0]=1 11 B23R3.10324912 CN(C)CCCN1C2=CC(=CC=C2SC3C1C=CC=C3)Cl MCULE-3468314078 [0,0,0,0,0,0|0,0,2]=2 12 B23R3.10324912 CN(C)CCCN1C2=CC(=CC=C2SC3C1C=CC=C3)Cl MCULE-7048402492 [0,0,0,0,0,0|0,0,2]=2 13 B22R3.12627800 CNCC/C=C\1/C2=C(C=CC=C2)SC3=C1C=C(C=C3)Cl MCULE-4509603180 [1,0,0,0,0,0|1,0,1]=3 14 B22R3.12627800 CNCCC=C1C2=CC=CC=C2SC3=CC=C(C=C13)Cl MCULE-1610785850 [1,0,0,0,0,0|1,0,1]=3 15 B22R3.16182945 CN(C)CC/C=C/1\C2=CC=CC=C2SC3=C1C=CC=C3 MCULE-8873728994 [1,0,0,0,0,0|1,0,1]=3 16 B22R3.16182945 CN(C)CCC=S1C2=C(C=CC=C2)CC3=C1C=CC=C3 MCULE-2325191803 [1,0,0,0,0,0|2,0,1]=4 17 B22R3.16182945 CN(C)CCCN1C2=C(C=CC=C2)SC3=C1N=CC=C3 MCULE-5105926538 [1,0,0,0,0,0|1,0,0]=2 18 B22R3.16182945 CN(C)CCCN1C2=CC=CC=C2SC3=CC=CC=C13 MCULE-2454310422 [1,0,0,0,0,0|0,0,0]=1 19 B22R3.16182945 CN(C)CCCN1C2=CC=CC=C2SC3=CC=CC=C13 MCULE-8672883746 [1,0,0,0,0,0|0,0,0]=1 20 B22R3.16182945 O=C(O)CCCN1C2=CC=CC=C2SC3=C1C=CC=C3 MCULE-9384223189 [1,0,0,0,0,0|3,0,0]=4 21 B24R3.11986227 CN(C)CCC=C1C2=CC=C(C=C2SC3=C1C=C(C=C3)Cl)O MCULE-2513337423 [0,1,0,0,0,0|1,0,1]=3 22 B24R3.11986227 CN(C)CCC=C1C2=CC=C(C=C2SC3=C1C=C(C=C3)Cl)O MCULE-7980639028 [0,1,0,0,0,0|1,0,1]=3 23 B24R3.11986227 CN(C)CCCN1C2=C(C=C(C=C2)O)SC3=C1C=C(C=C3)Cl MCULE-9597276291 [0,1,0,0,0,0|0,0,0]=1 24 B24R3.11986227 CN(C)CCCN1C2=CC=C(C=C2SC3=C1C=C(C=C3)Cl)O MCULE-7506504662 [0,1,0,0,0,0|0,0,0]=1 25 B24R3.13731091 CN(C)CCC=C1C2=C(C=CC=C2)SC3=C1C=C(C(=C3)O)Cl MCULE-4756337702 [0,1,0,0,0,0|1,0,1]=3 26 B24R3.13731091 CN(C)CCC=C1C2=C(C=CC=C2)SC3=C1C=C(C(=C3)O)Cl MCULE-7791700371 [0,1,0,0,0,0|1,0,1]=3 27 B24R3.13731091 CN(C)CCC=C1C2=CC(=C(C=C2SC3=C1C=CC=C3)F)Cl MCULE-2253547590 [0,1,0,0,0,0|1,0,1]=3 28 B24R3.13731091 CN(C)CCC=C1C2=CC(=C(C=C2SC3=C1C=CC=C3)F)Cl MCULE-4386952546 [0,1,0,0,0,0|1,0,1]=3 29 B24R3.15111195 CN(C)CCC(=O)N1C2=C(C=CC=C2)SC3=C1C=C(C=C3)Cl MCULE-2698513176 [0,1,0,0,0,0|0,0,1]=2 30 B24R3.15111195 CN(C)CCC(=O)N1C2=C(C=CC=C2)SC3=C1C=C(C=C3)Cl MCULE-7992757150 [0,1,0,0,0,0|0,0,1]=2 31 B24R3.15113496 C[N+](C)(C)CCC=C1C2=CC=CC=C2SC3=C1C=C(C=C3)Cl MCULE-2004064650 [0,1,0,0,0,0|1,0,2]=4 32 B24R3.15113496 C[N+](C)(C)CCC=C1C2=CC=CC=C2SC3=C1C=C(C=C3)Cl MCULE-2839136484 [0,1,0,0,0,0|1,0,2]=4 33 B24R3.25384571 CN(C)CCCN1C2=C(C=CC=C2)S(=O)C3=C1C=C(C=C3)Cl MCULE-2088133902 [0,1,0,0,0,0|0,0,1]=2 34 B24R3.25384571 CN(C)CCCN1C2=C(C=CC=C2)S(=O)C3=C1C=C(C=C3)Cl MCULE-6238383870 [0,1,0,0,0,0|0,0,1]=2 35 B24R3.25384571 CN(C)CCCN1C2=CC=CC=C2[S@@](=O)C3=C1C=C(C=C3)Cl MCULE-6091985011 [0,1,0,0,0,0|0,0,1]=2 36 B24R3.53940934 CN(C)CCC=C1C2=C(C=CC=C2)SC3=C1C=C(C=C3O)Cl MCULE-1403233456 [0,1,0,0,0,0|1,0,1]=3 37 B24R3.53940934 CN(C)CCC=C1C2=C(C=CC=C2)SC3=C1C=C(C=C3O)Cl MCULE-7720974333 [0,1,0,0,0,0|1,0,1]=3 38 B24R3.118808131 CN(C)CCC=C1C2=C(C=CC(=C2)F)SC3=C1C=C(C=C3)Cl MCULE-3138285824 [0,1,0,0,0,0|1,0,1]=3 39 B24R3.118808131 CN(C)CCC=C1C2=C(C=CC(=C2)F)SC3=C1C=C(C=C3)Cl MCULE-3931726748 [0,1,0,0,0,0|1,0,1]=3 40 B22R2.4399 CC1=CC=C(C=C1)OC2=C(C=CC=C2)OCCCN(C)C MCULE-4227754134 [0,0,1,0,0,0|2,1,0]=4 41 B22R2.4399 CN(C)CCCOC1=C(C=CC=C1)OC2=CC=C(C=C2)Cl MCULE-4794006999 [0,0,1,0,0,0|1,1,0]=3 42 B22R2.3988806 CN(C)CCOC(C1=CC(=CC=C1)Cl)C2=C(C=CC=C2)Cl MCULE-5456691643 [0,0,1,0,0,0|3,0,0]=4 43 B24R3.2679831 CN(C)CCOC1=CC2=CC=CC=C2SC3=CC=C(C=C13)Cl MCULE-9082713433 [0,0,0,0,0,1|2,0,0]=3 44 B24R3.15111086 CN(C)CCSC1CC2=CC(=CC=C2SC3=CC=CC=C13)Cl MCULE-1071837622 [0,0,0,0,0,1|2,0,0]=3 45 B24R3.15111086 CN(C)CCSC1CC2=CC(=CC=C2SC3=CC=CC=C13)Cl MCULE-9674361951 [0,0,0,0,0,1|2,0,0]=3 46 B24R3.118819978 CN(C)CCC=C1C2=CC(=CC=C2CSC3=C1C=CC=C3)F MCULE-5804039035 [0,0,0,0,0,1|1,1,1]=4 47 B24R3.118819978 CN(C)CCC=C1C2=CC(=CC=C2CSC3=C1C=CC=C3)F MCULE-9742188899 [0,0,0,0,0,1|1,1,1]=4 48 B24R3.118819978 CN(C)CCCN1C2=C(C=CC=C2)CCC3=C1C=C(C=C3)Cl MCULE-6443168248 [0,0,0,0,0,1|1,0,0]=2 49 B24R3.118819978 C[NH+](C)CCCN1C2=C(C=CC=C2)CCC3=C1C=C(C=C3)Cl MCULE-6495409435 [0,0,0,0,0,1|1,0,1]=3 50 B21R3.590553 ClCCCN1C2=C(C=CC=C2)SC3=C1C=C(C=C3)Cl MCULE-3461350417 [2,0,0,0,0,0|1,0,0]=3 51 B21R3.590553 N#CCCN1C2=CC(=CC=C2SC3=C1C=CC=C3)Cl MCULE-9825662778 [2,0,0,0,0,0|0,0,2]=4 52 B21R3.8069667 CNCCCN1C2=C(C=CC=C2)SC3=C1C=CC=C3 MCULE-2846422713 [2,0,0,0,0,0|0,0,0]=2 53 B21R3.8069667 NCCCCN1C2=C(C=CC=C2)SC3=C1C=CC=C3 MCULE-4965768353 [2,0,0,0,0,0|2,0,0]=4 54 B23R2.728745 CN(C)CCCOC1=C(C=CC(=C1)F)OC2=CC=C(C=C2)Cl MCULE-1656000096 [0,1,1,0,0,0|1,1,0]=4 55 B23R2.4893334 CN(C)CCCOC1=C(C(=CC=C1)F)OC2=CC=C(C=C2)Cl MCULE-6799944579 [0,1,1,0,0,0|1,1,0]=4 56 B23R3.17309 CN(C)CCCN1C2=CC=CC=C2SC3=CC(=CC=C13)Cl MCULE-9529964281 [1,1,0,0,0,0|0,0,0]=2 57 B23R3.41925352 CN(C)CCC(=O)N1C2=C(C=CC=C2)SC3=C1C=CC=C3 MCULE-2512233993 [1,1,0,0,0,0|0,0,1]=3 58 B23R3.71886310 CC(CN(C)C)CN1C2=CC=CC=C2SC3=C1C=CC=C3 MCULE-3095158236 [1,1,0,0,0,0|0,0,0]=2 59 B23R3.71886310 CC(CN(C)C)CN1C2=CC=CC=C2SC3=CC=CC=C13 MCULE-5182129377 [1,1,0,0,0,0|0,0,0]=2 60 B23R3.71886310 CC(CN(C)C)CN1C2=CC=CC=C2SC3=CC=CC=C13 MCULE-6238833953 [1,1,0,0,0,0|0,0,0]=2 61 B23R3.10326069 CN(C)CC(=O)N1C2=CC(=CC=C2SC3=C1C=CC=C3)Cl MCULE-2259673123 [0,1,0,0,1,0|0,0,1]=3 62 B23R3.10326069 CN(C)CC(=O)N1C2=CC(=CC=C2SC3=C1C=CC=C3)Cl MCULE-6916109071 [0,1,0,0,1,0|0,0,1]=3 63 B25R3.84471985 CN(C)CCCN1C2=CC=CC=C2CCC3=CC=C(C=C13)C#N MCULE-5467627655 [0,1,0,0,0,1|2,0,0]=4 64 B25R3.84471985 CN(C)CCCN1C2=CC=CC=C2CCC3=CC=C(C=C13)C#N MCULE-7021340652 [0,1,0,0,0,1|2,0,0]=4 65 B25R3.152452223 CN(C)CCCN1C2=CC(=CC=C2CCC3=CC=C(C=C13)Cl)Cl MCULE-6087317313 [0,1,0,0,0,1|1,0,0]=3 66 B25R3.14411519 CN(C)CCC=C1C2=CC(=C(C=C2SC3=C1C=CC(=C3)F)F)Cl MCULE-4369400742 [0,2,0,0,0,0|1,0,1]=4 67 B25R3.14411519 CN(C)CCC=C1C2=CC(=C(C=C2SC3=C1C=CC(=C3)F)F)Cl MCULE-7784615291 [0,2,0,0,0,0|1,0,1]=4 68 B25R3.2302892839 CN(C)CCC=C1C2=CC(=CC=C2SC3=C1C=C(C(=C3)F)F)Cl MCULE-1290091412 [0,2,0,0,0,0|1,0,1]=4 69 B25R3.2302892839 CN(C)CCC=C1C2=CC(=CC=C2SC3=C1C=C(C(=C3)F)F)Cl MCULE-9564233651 [0,2,0,0,0,0|1,0,1]=4 70 B25R3.54736069 CC(CN(C)C)CN1C2=C(C=CC=C2)SC3=C1C=C(C=C3)C#N MCULE-8018996913 [0,2,0,0,0,0|1,0,0]=3 71 B25R3.54736069 CCC1=CC2=C(C=C1)SC3=CC=CC=C3N2CC(C)CN(C)C MCULE-1877977606 [0,2,0,0,0,0|1,0,0]=3 72 B25R3.54736069 CCC1=CC2=C(C=C1)SC3=CC=CC=C3N2CC(C)CN(C)C MCULE-5583801559 [0,2,0,0,0,0|1,0,0]=3 73 B25R3.54736069 COC1=CC2=C(C=C1)SC3=C(N2CC(C)CN(C)C)C=CC=C3 MCULE-2449256469 [0,2,0,0,0,0|1,0,0]=3 74 B25R3.54736069 COC1=CC2=C(C=C1)SC3=C(N2C[C@H](C)CN(C)C)C=CC=C3 MCULE-5088689273 [0,2,0,0,0,0|1,0,0]=3 75 B25R3.54736069 COC1=CC2=C(C=C1)SC3=CC=CC=C3N2C[C@H](C)CN(C)C MCULE-5043495236 [0,2,0,0,0,0|1,0,0]=3 76 B25R3.54736069 COC1=CC2=C(C=C1)SC3=CC=CC=C3N2C[C@H](C)CN(C)C MCULE-9439425487 [0,2,0,0,0,0|1,0,0]=3 77 B25R3.54736069 COC1=CC=C2SC3=C(C=CC=C3)N(C2=C1)CC(C)CN(C)C MCULE-9700381354 [0,2,0,0,0,0|1,0,0]=3 78 B25R3.54736069 COC1=CC=C2SC3=CC=CC=C3N(C2=C1)C[C@H](C)CN(C)C MCULE-3032805080 [0,2,0,0,0,0|1,0,0]=3 79 B25R3.54736069 CSC1=CC=C2SC3=CC=CC=C3N(C2=C1)CC(C)CN(C)C MCULE-1512528624 [0,2,0,0,0,0|1,0,0]=3 80 B25R3.14458814 CN(C)CCCN1C2=CC=CC=C2S(=O)(=O)C3=C1C=C(C=C3)Cl MCULE-4751908971 [0,2,0,0,0,0|0,0,1]=3 81 B25R3.14458814 CN(C)CCCN1C2=CC=CC=C2S(=O)(=O)C3=C1C=C(C=C3)Cl MCULE-8471005931 [0,2,0,0,0,0|0,0,1]=3 82 B25R3.123138798 CCN(CC)CCCN1C2=CC=CC=C2SC3=C1C=C(C=C3)Cl MCULE-8704281261 [0,2,0,0,0,0|0,0,0]=2 83 B25R3.123138798 CC[NH+](CC)CCCN1C2=C(C=CC=C2)SC3=C1C=C(C=C3)Cl MCULE-1749634268 [0,2,0,0,0,0|0,0,1]=3 84 B25R3.319289155 CC(=O)C1=CC2=C(C=C1)SC3=CC=CC=C3N2CCC[NH+](C)C MCULE-4395492095 [0,2,0,0,0,0|1,0,1]=4 85 B25R3.319289155 CC(=O)C1=CC=C2SC3=C(C=CC=C3)N(C2=C1)CCCN(C)C MCULE-1881717701 [0,2,0,0,0,0|1,0,0]=3 86 B25R3.319289155 CC(=O)C1=CC=C2SC3=C(C=CC=C3)N(C2=C1)CCCN(C)C MCULE-2290654141 [0,2,0,0,0,0|1,0,0]=3 87 B25R3.319289155 CC(=O)C1=CC=C2SC3=C(C=CC=C3)N(C2=C1)CCCN(C)C MCULE-9714174953 [0,2,0,0,0,0|1,0,0]=3 88 B25R3.52398032 COC1=C2SC3=C(C=CC=C3)C(=CCCN(C)C)C2=CC(=C1)Cl MCULE-5579317392 [0,2,0,0,0,0|1,0,1]=4 89 B25R3.52398032 COC1=C2SC3=C(C=CC=C3)C(=CCCN(C)C)C2=CC(=C1)Cl MCULE-8857134873 [0,2,0,0,0,0|1,0,1]=4 90 B23R3.10324854 CN(C)CCC1=CC2=C(C=CC(=C2)Cl)SC3=CC=CC=C13 MCULE-2889935073 [0,0,1,1,0,0|1,0,1]=4 91 B23R3.10324854 CN(C)CCC1=CC2=C(C=CC(=C2)Cl)SC3=CC=CC=C13 MCULE-8282397808 [0,0,1,1,0,0|1,0,1]=4 92 B21R2.4552 CN(C)CCOC1=C(C=CC=C1)OC2=CC=C(C=C2)Cl MCULE-5065767307 [0,0,1,0,1,0|1,1,0]=4 93 B21R3.7877738 CN(C)CCN1C2=CC=CC=C2SC3=CC=CC=C13 MCULE-2432442328 [1,0,0,0,1,0|0,0,0]=2 94 B21R3.7877738 CN(C)CCN1C2=CC=CC=C2SC3=CC=CC=C13 MCULE-6877848962 [1,0,0,0,1,0|0,0,0]=2 95 B21R3.9913503 CN(C)CCOC1C2=CC=CC=C2C3=C1C=CC=C3 MCULE-7246942383 [1,0,0,0,1,0|2,0,0]=4 96 B21R3.9913503 CN(C)CCOC1C2=CC=CC=C2C3=C1C=CC=C3 MCULE-8156128631 [1,0,0,0,1,0|2,0,0]=4 97 B23R3.38836458 CNCCCN1C2=C(C=CC=C2)CCC3=C1C=C(C=C3)Cl MCULE-6661788203 [1,0,0,0,0,1|1,0,0]=3 98 B23R3.38836458 CNCCCN1C2=C(C=CC=C2)CCC3=C1C=C(C=C3)Cl MCULE-7878739491 [1,0,0,0,0,1|1,0,0]=3 99 B23R3.19159989 CN(C)CCCNC1=C2C=CC=CC2=NC3=CC=CC=C13 MCULE-4870762644 [1,0,0,0,0,1|2,0,0]=4 100 B23R3.19281841 CN(C)CCCC1OC2=C(C=CC=C2)SC3=C1C=CC=C3 MCULE-2197208538 [1,0,0,0,0,1|1,0,0]=3 101 B23R3.19281841 CN(C)CCCC1OC2=C(C=CC=C2)SC3=C1C=CC=C3 MCULE-4149895681 [1,0,0,0,0,1|1,0,0]=3 102 B23R3.19281841 CN(C)CCCC1SC2=C(C=CC=C2)SC3=C1C=CC=C3 MCULE-5875785021 [1,0,0,0,0,1|1,0,0]=3 103 B23R3.19281841 CN(C)CCCN1CC2=C(C=CC=C2)SC3=C1C=CC=C3 MCULE-2074892026 [1,0,0,0,0,1|0,0,0]=2 104 B23R3.19281841 CN(C)CCCN1CC2=C(C=CC=C2)SC3=C1C=CC=C3 MCULE-6244513537 [1,0,0,0,0,1|0,0,0]=2 105 B23R3.26139327 CN(C)CC/C=C\1/C2=C(C=CC=C2)CSC3=C1C=CC=C3 MCULE-7205279069 [1,0,0,0,0,1|1,0,1]=4 106 B23R3.26139327 CN(C)CC/C=C\1/C2=CC=CC=C2CSC3=C1C=CC=C3 MCULE-5101040536 [1,0,0,0,0,1|1,0,1]=4 107 B23R3.26139327 CN(C)CCC=C1C2=CC=CC=C2SCC3=C1C=CC=C3 MCULE-2446742562 [1,0,0,0,0,1|1,0,1]=4 108 B23R3.26139327 CN(C)CCC=C1C2=CC=CC=C2SCC3=C1C=CC=C3 MCULE-9679646305 [1,0,0,0,0,1|1,0,1]=4 109 B23R3.26139327 CN(C)CCCC1C2=C(C=CC=C2)CSC3=C1C=CC=C3 MCULE-6147328510 [1,0,0,0,0,1|1,0,0]=3 110 B23R3.26139327 CN(C)CCCC1C2=C(C=CC=C2)CSC3=C1C=CC=C3 MCULE-8333525450 [1,0,0,0,0,1|1,0,0]=3 111 B23R3.26139327 CN(C)CCCN1C2=C(C=CC=C2)C=CC3=C1C=CC=C3 MCULE-3586093892 [1,0,0,0,0,1|1,0,0]=3 112 B23R3.26139327 CN(C)CCCN1C2=C(C=CC=C2)C=CC3=C1C=CC=C3 MCULE-8657281348 [1,0,0,0,0,1|1,0,0]=3 113 B23R3.26139327 CN(C)CCCN1C2=C(C=CC=C2)CCC3=C1C=CC=C3 MCULE-5997199711 [1,0,0,0,0,1|1,0,0]=3 114 B23R3.26139327 CN(C)CCCN1C2=C(C=CC=C2)CCC3=C1C=CC=C3 MCULE-9471074673 [1,0,0,0,0,1|1,0,0]=3 115 B23R3.26139327 CN(C)CCOC1C2=C(C=CC=C2)CSC3=C1C=CC=C3 MCULE-5492489613 [1,0,0,0,0,1|2,0,0]=4 116 B23R3.26139327 CN(C)CCSC1C2=C(C=CC=C2)CSC3=C1C=CC=C3 MCULE-2163615317 [1,0,0,0,0,1|2,0,0]=4 117 B23R3.26139327 CN(C)CCSC1C2=C(C=CC=C2)CSC3=C1C=CC=C3 MCULE-7102788227 [1,0,0,0,0,1|2,0,0]=4 118 B25R3.18472750 CN(C)CCCSC1CC2=CC(=CC=C2SC3=CC=CC=C13)Cl MCULE-3256125500 [0,0,0,0,0,2|1,0,0]=3 119 B25R3.18472750 CN(C)CCCSC1CC2=CC(=CC=C2SC3=CC=CC=C13)Cl MCULE-5667436328 [0,0,0,0,0,2|1,0,0]=3