0 B15R2.7473 CC1=C(C=CC=C1)C2=NN=C(N2C)S Z56942053 [0,0,0,0,0,0|1,0,2]=3 1 B15R2.7473 CC1=C(C=CC=C1)C2=NN=C(N2N)S Z56948374 [0,0,0,0,0,0|0,0,2]=2 2 B15R2.7473 CC1=C(C=CN=C1)C2=NNC(=C2C)N Z2028472578 [0,0,0,0,0,0|4,0,0]=4 3 B15R2.7473 CN1C(=NN=C1C2=C(C=CC=C2)Cl)S Z56978026 [0,0,0,0,0,0|2,0,2]=4 4 B15R2.7473 CN1C(=NN=C1C2=C(C=CC=C2)F)S Z56945545 [0,0,0,0,0,0|2,0,2]=4 5 B15R2.7473 CN1C(=O)ON=C1C2=C(C=CC=C2)Cl Z1653033354 [0,0,0,0,0,0|3,1,0]=4 6 B15R2.7473 NN1C(=NN=C1C2=C(C=CC=C2)Br)S Z55981939 [0,0,0,0,0,0|1,0,2]=3 7 B15R2.7473 NN1C(=NN=C1C2=C(C=CC=C2)Cl)S Z55981938 [0,0,0,0,0,0|1,0,2]=3 8 B15R2.7473 NN1C(=NN=C1C2=C(C=CC=C2)F)S Z55981968 [0,0,0,0,0,0|1,0,2]=3 9 B14R2.256 CC1=C(C=CC=C1)C2=CSC(=O)N2 Z409413504 [1,0,0,0,0,0|2,1,0]=4 10 B14R2.256 CC1=C(C=CC=C1)C2=NC(=S)ON2 Z1381260338 [1,0,0,0,0,0|1,0,2]=4 11 B14R2.256 CC1=C(C=CC=C1)C2=NN=C(N2)N Z744754768 [1,0,0,0,0,0|1,0,1]=3 12 B14R2.256 CC1=C(C=CC=C1)C2=NN=C(O2)N Z285233846 [1,0,0,0,0,0|2,0,1]=4 13 B14R2.256 CC1=C(C=CC=C1)C2=NN=C(O2)S Z56347055 [1,0,0,0,0,0|1,0,2]=4 14 B14R2.256 CC1=C(C=CC=C1)C2=NNC(=C2)N Z317042210 [1,0,0,0,0,0|2,0,0]=3 15 B14R2.256 CC1=C(C=CC=C1)C2=NOC(=C2)N Z335438982 [1,0,0,0,0,0|3,0,0]=4 16 B14R2.256 CC1=C(C=CC=C1)C2=NOC(=O)N2 Z685593994 [1,0,0,0,0,0|1,1,0]=3 17 B14R2.256 CC1=NN=C(N1)C2=C(C=CC=C2)F Z927193316 [1,0,0,0,0,0|2,0,1]=4 18 B14R2.256 FC1=C(C=CC=C1)C2=NN=C(N2)S Z56974796 [1,0,0,0,0,0|1,0,2]=4 19 B14R2.256 NC1=C(C=CC=C1)C2=NN=C(N2)S Z169856762 [1,0,0,0,0,0|1,0,2]=4 20 B14R2.256 NC1=CC(=NN1)C2=C(C=CC=C2)Br Z752370828 [1,0,0,0,0,0|3,0,0]=4 21 B14R2.256 NC1=NC(=NN1)C2=C(C=CC=C2)F Z1211229413 [1,0,0,0,0,0|2,0,1]=4 22 B14R2.256 NC1=NN=C(N1)C2=C(C=CC=C2)Br Z104346776 [1,0,0,0,0,0|2,0,1]=4 23 B14R2.256 NC1=NN=C(N1)C2=C(C=CC=C2)Cl Z1245633261 [1,0,0,0,0,0|2,0,1]=4 24 B14R2.256 O=C1CC(=NN1)C2=C(C=CC=C2)Cl Z3222424431 [1,0,0,0,0,0|2,1,0]=4 25 B14R2.256 O=C1CC(=NN1)C2=C(C=CC=C2)O Z56174893 [1,0,0,0,0,0|2,1,0]=4 26 B14R2.256 OC1=C(C=CC=C1)C2=NN=C(N2)S Z56904584 [1,0,0,0,0,0|1,0,2]=4 27 B14R2.296 CC1=C(C=CC=C1)C2=NON=C2N Z992248560 [1,0,0,0,0,0|3,0,0]=4 28 B14R2.296 CN1C=NN=C1C2=C(C=CC=C2)Br Z1269155379 [1,0,0,0,0,0|2,0,1]=4 29 B14R2.296 CN1C=NN=C1C2=C(C=CC=C2)N Z381338436 [1,0,0,0,0,0|2,0,1]=4 30 B14R2.296 NC1=CSN=C1C2=C(C=CC=C2)Cl Z1267500425 [1,0,0,0,0,0|3,0,0]=4 31 B14R2.4514 CC1=C(C(=NO1)C2=CC=CC=C2)N Z3015399862 [1,0,0,0,0,0|3,0,0]=4 32 B14R2.4514 CC1=C(NN=C1C2=CC=CC=C2)N Z234485060 [1,0,0,0,0,0|3,0,0]=4 33 B14R2.4514 CN1C(=NN=C1C2=CC=CC=C2)Cl Z324550900 [1,0,0,0,0,0|2,0,1]=4 34 B14R2.4514 CN1C(=NN=C1C2=CC=CC=C2)S Z56853821 [1,0,0,0,0,0|1,0,2]=4 35 B14R2.4514 CN1C(=O)NN=C1C2=CC=CC=C2 Z1504682160 [1,0,0,0,0,0|1,1,0]=3 36 B14R2.4514 CN1C(=O)ON=C1C2=CC=CC=C2 Z955193402 [1,0,0,0,0,0|2,1,0]=4 37 B14R2.4514 NN1C(=NN=C1C2=CC=CC=C2)S Z55981942 [1,0,0,0,0,0|0,0,2]=3 38 B14R2.4514 NN1C(=NN=C1C2=CC=NC=C2)S Z55981935 [1,0,0,0,0,0|1,0,2]=4 39 B14R2.4514 NN1C(=NN=C1C2=CN=CC=C2)S Z55981946 [1,0,0,0,0,0|1,0,2]=4 40 B14R2.4514 NN1C(=NN=C1C2=NC=CC=C2)S Z55981936 [1,0,0,0,0,0|1,0,2]=4 41 B16R2.2645 CCN1C(=NN=C1C2=C(C=CC=C2)C)S Z57577602 [0,1,0,0,0,0|1,0,2]=4 42 B16R2.2645 CCN1C(=O)ON=C1C2=C(C=CC=C2)C Z995389448 [0,1,0,0,0,0|2,1,0]=4 43 B16R2.7895 CC1=NN=C(N1C)C2=C(C=CC=C2)CO Z2467455012 [0,1,0,0,0,0|2,0,1]=4 44 B16R2.7895 COC1=C(C=CC=C1)C2=NN=C(N2C)S Z56951807 [0,1,0,0,0,0|1,0,2]=4 45 B16R2.7895 COC1=C(C=CC=C1)C2=NN=C(N2N)S Z56851184 [0,1,0,0,0,0|0,0,2]=3 46 B16R2.7895 COC1=C(C=CC=C1)C2=NNC(=C2C)N Z2887843720 [0,1,0,0,0,0|3,0,0]=4 47 B16R2.12646 NN1C(=NN=C1C2=C(C=CC(=C2)Cl)Cl)S Z55982084 [0,1,0,0,0,0|1,0,2]=4 48 B16R2.75907 CSC1=NN=C(N1C)C2=C(C=CC=C2)C Z19932276 [0,1,0,0,0,0|1,0,2]=4 49 B16R2.84468 NN1C(=NN=C1C2=C(C=C(C=C2)Cl)Cl)S Z56853817 [0,1,0,0,0,0|1,0,2]=4 50 B14R1.837 CNC(=S)N/N=C/C1=C(C=CC=C1)Cl Z49612344 [0,0,1,0,0,0|2,0,0]=3 51 B14R1.837 CSC(=S)N/N=C/C1=C(C=CC=C1)O Z56174616 [0,0,1,0,0,0|3,0,0]=4 52 B14R2.4747 CC1=C(C=CO1)C2=NN=C(N2N)S Z55982025 [0,0,0,0,1,0|1,0,2]=4 53 B16R2.12418 NN1C(=NN=C1CC2=C(C=CC=C2)F)S Z56919233 [0,0,0,0,0,1|1,0,2]=4 54 B13R1.158 CC1=C(C=CC=C1)/C=N/NC(=N)N Z56859479 [1,0,1,0,0,0|1,0,0]=3 55 B13R1.158 N=C(N)N/N=C/C1=C(C=CC=C1)Br Z204293904 [1,0,1,0,0,0|2,0,0]=4 56 B13R1.158 N=C(N)N/N=C/C1=C(C=CC=C1)Cl Z204610086 [1,0,1,0,0,0|2,0,0]=4 57 B13R1.158 NC(=O)N/N=C/C1=C(C=CC=C1)Br Z49560875 [1,0,1,0,0,0|1,1,0]=4 58 B13R1.158 NC(=S)N/N=C/C1=C(C=CC=C1)Cl Z49561500 [1,0,1,0,0,0|1,0,0]=3 59 B13R1.158 NC(=S)N/N=C/C1=C(C=CC=C1)O Z49561499 [1,0,1,0,0,0|1,0,0]=3 60 B13R1.718 CSC(=S)N/N=C/C1=CC=CC=C1 Z56808875 [1,0,1,0,0,0|2,0,0]=4 61 B13R1.718 NNC(=S)NCCC1=CC=CC=C1 Z56828395 [1,0,1,0,0,0|1,0,1]=4 62 B13R2.10 NC1=NC(=NN1)C2=CC=CC=C2 Z1891772907 [2,0,0,0,0,0|1,0,1]=4 63 B13R2.10 O=C1CC(=NN1)C2=CC=CC=C2 Z50145997 [2,0,0,0,0,0|1,1,0]=4 64 B13R2.10 O=C1NC(=NO1)C2=CC=CC=C2 Z685594006 [2,0,0,0,0,0|1,1,0]=4 65 B13R2.10 O=C1NN=C(S1)C2=CC=CC=C2 Z1486022130 [2,0,0,0,0,0|1,1,0]=4 66 B13R2.18 BrC1=C(C=CC=C1)C2=NC=CN2 Z851790692 [2,0,0,0,0,0|2,0,0]=4 67 B13R2.18 BrC1=C(C=CC=C1)C2=NNC=C2 Z815437676 [2,0,0,0,0,0|2,0,0]=4 68 B13R2.18 CC1=C(C=CC=C1)C2=NNN=N2 Z56891226 [2,0,0,0,0,0|1,0,1]=4 69 B13R2.18 NC1=C(C=CC=C1)C2=NC=CN2 Z815309798 [2,0,0,0,0,0|2,0,0]=4 70 B13R2.18 NC1=C(C=CC=C1)C2=NN=CN2 Z1575312107 [2,0,0,0,0,0|1,0,1]=4 71 B13R2.18 OC1=C(C=CC=C1)C2=NN=CN2 Z1412755279 [2,0,0,0,0,0|1,0,1]=4 72 B13R2.15 BrC1=CNN=C1C2=CC=CC=C2 Z815438332 [2,0,0,0,0,0|2,0,0]=4 73 B13R2.15 CN1C=NN=C1C2=CC=CC=C2 Z1255361478 [2,0,0,0,0,0|1,0,1]=4 74 B13R2.15 NC1=CON=C1C2=CC=CC=C2 Z3305978063 [2,0,0,0,0,0|2,0,0]=4 75 B13R2.15 NC1=CSN=C1C2=CC=CC=C2 Z1262253366 [2,0,0,0,0,0|2,0,0]=4 76 B13R2.15 OC1=CNN=C1C2=CC=CC=C2 Z4464308114 [2,0,0,0,0,0|2,0,0]=4 77 B15R1.257 CC1=C(C=CC=C1)/C=N/NC(=O)C(=O)N Z49644847 [0,1,1,0,0,0|1,1,0]=4 78 B15R1.3175 CNC(=S)N/N=C/C1=C(C=CC(=C1)C)C Z49612636 [0,1,1,0,0,0|1,0,0]=3 79 B15R1.3836 CNC(=S)N/N=C/C1=C(C=C(C=C1)F)F Z49612470 [0,1,1,0,0,0|2,0,0]=4 80 B15R1.42427 CNC(=S)N/N=C/C1=C(C=CC=C1Cl)Cl Z49612588 [0,1,1,0,0,0|2,0,0]=4 81 B15R1.42427 CNC(=S)N/N=C/C1=C(C=CC=C1F)F Z49612614 [0,1,1,0,0,0|2,0,0]=4 82 B15R2.303 CC1=C(C(=CC=C1)C2=NNC(=C2)N)C Z317042248 [1,1,0,0,0,0|2,0,0]=4 83 B15R2.554 CC1=C(C=CC=C1)C2=NN(C(=C2)N)C Z385401582 [1,1,0,0,0,0|2,0,0]=4 84 B15R2.1153 CC1=CC(=C(C=C1)C2=NN=C(N2)N)C Z111411714 [1,1,0,0,0,0|1,0,1]=4 85 B15R2.1153 NC1=C(C=CC(=C1)F)C2=NNC(=O)N2 Z805424042 [1,1,0,0,0,0|1,1,0]=4 86 B15R2.2189 COC1=C(C=CC=C1)C2=NN=C(N2)N Z381785790 [1,1,0,0,0,0|1,0,1]=4 87 B15R2.2189 COC1=C(C=CC=C1)C2=NNC(=C2)N Z317042260 [1,1,0,0,0,0|2,0,0]=4 88 B15R2.2189 COC1=C(C=CC=C1)C2=NNC(=N2)S Z57477045 [1,1,0,0,0,0|0,0,2]=4 89 B15R2.2189 COC1=C(C=CC=C1)C2=NNC(=O)C2 Z1198218430 [1,1,0,0,0,0|1,1,0]=4 90 B15R2.7137 CN1C(=O)NN=C1C2=CC(=CC=C2)Br Z1269238752 [1,1,0,0,0,0|1,1,0]=4 91 B15R2.7137 NN1C(=NN=C1C2=CC(=CC=C2)Br)S Z85934155 [1,1,0,0,0,0|0,0,2]=4 92 B15R2.7137 NN1C(=NN=C1C2=CC(=CC=C2)Cl)S Z55982042 [1,1,0,0,0,0|0,0,2]=4 93 B15R2.7137 NN1C(=NN=C1C2=CC(=CC=C2)F)S Z56974786 [1,1,0,0,0,0|0,0,2]=4 94 B15R2.18933 CC1=CC=C(C=C1)C2=NN=C(N2N)S Z56828414 [1,1,0,0,0,0|0,0,2]=4 95 B15R2.18933 CC1=CC=C(C=C1)C2=NNC(=O)N2C Z2375609706 [1,1,0,0,0,0|1,1,0]=4 96 B15R2.18933 CN1C(=O)NN=C1C2=CC=C(C=C2)Br Z3779584089 [1,1,0,0,0,0|1,1,0]=4 97 B15R2.18933 CN1C(=O)NN=C1C2=CC=C(C=C2)Cl Z3671598453 [1,1,0,0,0,0|1,1,0]=4 98 B15R2.18933 CN1C(=O)NN=C1C2=CC=C(C=C2)N Z1262663374 [1,1,0,0,0,0|1,1,0]=4 99 B15R2.18933 CN1C(=O)NN=C1C2=CC=C(C=C2)O Z4605162110 [1,1,0,0,0,0|1,1,0]=4 100 B15R2.18933 NN1C(=NN=C1C2=CC=C(C=C2)Cl)S Z55981947 [1,1,0,0,0,0|0,0,2]=4 101 B15R2.18933 NN1C(=NN=C1C2=CC=C(C=C2)F)S Z55981940 [1,1,0,0,0,0|0,0,2]=4 102 B17R2.11225 CC1=C(C=CC=C1)C2=NN(C(=S)N2C)CO Z278208768 [0,2,0,0,0,0|1,0,0]=3 103 B17R2.9585 COC1=C(C=C(C=C1)C)C2=NN=C(N2N)S Z56919230 [0,2,0,0,0,0|0,0,2]=4 104 B17R2.47067 CCOC1=C(C=CC=C1)C2=NN=C(N2N)S Z85921190 [0,2,0,0,0,0|0,0,2]=4 105 B15R3.1739 C1=CC2=C(C=C1)C3=NNC=C3CC2 Z3227034312 [1,0,0,1,0,0|2,0,0]=4 106 B17R2.20645 CC1=C(C=CC=C1)CSC2=NNC(=O)N2C Z51532553 [0,0,0,0,0,2|1,1,0]=4