0 B11R1.91 CC(C)NCC1=CC=CN=C1 EB16331 [0,0,0,0,0,0|3,0,1]=4 1 B11R1.91 CC(C)NCC1=CC=CN=C1 EB16450 [0,0,0,0,0,0|3,0,1]=4 2 B11R1.91 CC(C)NCC1=CC=CN=C1 EB16459 [0,0,0,0,0,0|3,0,1]=4 3 B11R1.91 CC(C)NCC1=CC=NC=C1 EB16332 [0,0,0,0,0,0|3,0,1]=4 4 B11R1.91 CC(C)NCC1=CC=NC=C1 EB16451 [0,0,0,0,0,0|3,0,1]=4 5 B11R1.91 CC(C)NCC1=CC=NC=C1 EB16460 [0,0,0,0,0,0|3,0,1]=4 6 B11R1.91 CC(C)NCC1=NC=CC=C1 EB16330 [0,0,0,0,0,0|3,0,1]=4 7 B11R1.91 CC(C)NCC1=NC=CC=C1 EB16449 [0,0,0,0,0,0|3,0,1]=4 8 B11R1.91 CC(C)NCC1=NC=CC=C1 EB16458 [0,0,0,0,0,0|3,0,1]=4 9 B11R1.91 N=C(N)SCC1=CC=CC=C1 EB33079 [0,0,0,0,0,0|2,1,0]=3 10 B11R1.91 O=C(O)C#CC1=CC=CN=C1 EB11269 [0,0,0,0,0,0|3,0,1]=4 11 B11R1.91 O=C(O)C#CC1=CC=NC=C1 EB11268 [0,0,0,0,0,0|3,0,1]=4 12 B10R1.17 S=C=NCC1=CC=CC=C1 KEMIT004 [1,0,0,0,0,0|1,1,1]=4 13 B12R1.21 CC(C)NCC1=CC=C(Br)C=C1 EB16365 [0,1,0,0,0,0|2,0,1]=4 14 B12R1.21 CC(C)NCC1=CC=C(Br)C=C1 EB16427 [0,1,0,0,0,0|2,0,1]=4 15 B12R1.21 CC(C)NCC1=CC=C(Cl)C=C1 EB16308 [0,1,0,0,0,0|2,0,1]=4 16 B12R1.21 CC(C)NCC1=CC=C(Cl)C=C1 EB16383 [0,1,0,0,0,0|2,0,1]=4 17 B12R1.21 CC(C)NCC1=CC=C(F)C=C1 EB16328 [0,1,0,0,0,0|2,0,1]=4 18 B12R1.21 CC(C)NCC1=CC=C(F)C=C1 EB16410 [0,1,0,0,0,0|2,0,1]=4 19 B12R1.21 CC(C)NCC1=CC=C(O)C=C1 EB16310 [0,1,0,0,0,0|2,0,1]=4 20 B12R1.21 CC(C)NCC1=CC=C(O)C=C1 EB16385 [0,1,0,0,0,0|2,0,1]=4 21 B12R1.21 CC1=CC=C(C#CC(=O)O)C=C1 EB11256 [0,1,0,0,0,0|2,0,1]=4 22 B12R1.21 CC1=CC=C(CNC(C)C)C=C1 EB16325 [0,1,0,0,0,0|2,0,1]=4 23 B12R1.21 CC1=CC=C(CNC(C)C)C=C1 EB16403 [0,1,0,0,0,0|2,0,1]=4 24 B12R1.21 CC1=CC=C(CSC(=N)N)C=C1 EB33002 [0,1,0,0,0,0|2,1,0]=4 25 B12R1.21 CC1=CC=C(OCC(=O)Cl)C=C1 EB15036 [0,1,0,0,0,0|3,0,0]=4 26 B12R1.21 CC1=CC=C(\C=C\C(=O)Cl)C=C1 EB15040 [0,1,0,0,0,0|2,0,1]=4 27 B12R1.21 N=C(N)SCC1=CC=C(Br)C=C1 EB33094 [0,1,0,0,0,0|2,1,0]=4 28 B12R1.21 N=C(N)SCC1=CC=C(Cl)C=C1 EB33006 [0,1,0,0,0,0|2,1,0]=4 29 B12R1.21 N=C(N)SCC1=CC=C(F)C=C1 EB33009 [0,1,0,0,0,0|2,1,0]=4 30 B12R1.21 N=C(N)SCC1=CC=C(I)C=C1 EB33000 [0,1,0,0,0,0|2,1,0]=4 31 B12R1.21 O=C(Cl)\C=C\C1=CC=C(Cl)C=C1 EB15032 [0,1,0,0,0,0|2,0,1]=4 32 B12R1.21 O=C(O)C#CC1=CC=C(Cl)C=C1 EB11254 [0,1,0,0,0,0|2,0,1]=4 33 B12R1.21 O=C(O)C#CC1=CC=C(F)C=C1 EB11250 [0,1,0,0,0,0|2,0,1]=4 34 B12R1.125 CC(C)NCC1=C(Br)C=CC=C1 EB16367 [0,1,0,0,0,0|2,0,1]=4 35 B12R1.125 CC(C)NCC1=C(Br)C=CC=C1 EB16429 [0,1,0,0,0,0|2,0,1]=4 36 B12R1.125 CC(C)NCC1=C(Cl)C=CC=C1 EB16320 [0,1,0,0,0,0|2,0,1]=4 37 B12R1.125 CC(C)NCC1=C(Cl)C=CC=C1 EB16398 [0,1,0,0,0,0|2,0,1]=4 38 B12R1.125 CC(C)NCC1=C(F)C=CC=C1 EB16326 [0,1,0,0,0,0|2,0,1]=4 39 B12R1.125 CC(C)NCC1=C(F)C=CC=C1 EB16408 [0,1,0,0,0,0|2,0,1]=4 40 B12R1.125 CC(C)NCC1=C(O)C=CC=C1 EB16311 [0,1,0,0,0,0|2,0,1]=4 41 B12R1.125 CC(C)NCC1=C(O)C=CC=C1 EB16386 [0,1,0,0,0,0|2,0,1]=4 42 B12R1.125 CC1=C(C#CC(=O)O)C=CC=C1 EB11260 [0,1,0,0,0,0|2,0,1]=4 43 B12R1.125 CC1=C(CNC(C)C)C=CC=C1 EB16323 [0,1,0,0,0,0|2,0,1]=4 44 B12R1.125 CC1=C(CNC(C)C)C=CC=C1 EB16401 [0,1,0,0,0,0|2,0,1]=4 45 B12R1.125 CC1=C(CSC(=N)N)C=CC=C1 EB33088 [0,1,0,0,0,0|2,1,0]=4 46 B12R1.125 N=C(N)SCC1=C(Br)C=CC=C1 EB33085 [0,1,0,0,0,0|2,1,0]=4 47 B12R1.125 N=C(N)SCC1=C(Cl)C=CC=C1 EB33077 [0,1,0,0,0,0|2,1,0]=4 48 B12R1.125 N=C(N)SCC1=C(F)C=CC=C1 EB33012 [0,1,0,0,0,0|2,1,0]=4 49 B12R1.125 O=C(O)C#CC1=C(Cl)C=CC=C1 EB11252 [0,1,0,0,0,0|2,0,1]=4 50 B12R1.125 O=C(O)C#CC1=C(F)C=CC=C1 EB11263 [0,1,0,0,0,0|2,0,1]=4 51 B12R1.226 CC(C)NCC1=CC(Br)=CC=C1 EB16366 [0,1,0,0,0,0|2,0,1]=4 52 B12R1.226 CC(C)NCC1=CC(Br)=CC=C1 EB16428 [0,1,0,0,0,0|2,0,1]=4 53 B12R1.226 CC(C)NCC1=CC(Cl)=CC=C1 EB16321 [0,1,0,0,0,0|2,0,1]=4 54 B12R1.226 CC(C)NCC1=CC(Cl)=CC=C1 EB16399 [0,1,0,0,0,0|2,0,1]=4 55 B12R1.226 CC(C)NCC1=CC(F)=CC=C1 EB16327 [0,1,0,0,0,0|2,0,1]=4 56 B12R1.226 CC(C)NCC1=CC(F)=CC=C1 EB16409 [0,1,0,0,0,0|2,0,1]=4 57 B12R1.226 CC(C)NCC1=CC(O)=CC=C1 EB16309 [0,1,0,0,0,0|2,0,1]=4 58 B12R1.226 CC(C)NCC1=CC(O)=CC=C1 EB16384 [0,1,0,0,0,0|2,0,1]=4 59 B12R1.226 CC1=CC=CC(C#CC(=O)O)=C1 EB11259 [0,1,0,0,0,0|2,0,1]=4 60 B12R1.226 CC1=CC=CC(CNC(C)C)=C1 EB16324 [0,1,0,0,0,0|2,0,1]=4 61 B12R1.226 CC1=CC=CC(CNC(C)C)=C1 EB16402 [0,1,0,0,0,0|2,0,1]=4 62 B12R1.226 CC1=CC=CC(CSC(=N)N)=C1 EB33080 [0,1,0,0,0,0|2,1,0]=4 63 B12R1.226 N=C(N)SCC1=CC=CC(Br)=C1 EB33073 [0,1,0,0,0,0|2,1,0]=4 64 B12R1.226 N=C(N)SCC1=CC=CC(Cl)=C1 EB33091 [0,1,0,0,0,0|2,1,0]=4 65 B12R1.226 N=C(N)SCC1=CC=CC(F)=C1 EB33092 [0,1,0,0,0,0|2,1,0]=4 66 B12R1.226 O=C(O)C#CC1=CC(Cl)=CC=C1 EB11253 [0,1,0,0,0,0|2,0,1]=4 67 B12R1.226 O=C(O)C#CC1=CC(F)=CC=C1 EB11262 [0,1,0,0,0,0|2,0,1]=4 68 B12R2.24 CC1=NC2=CC=CC=C2N=C1 EB61706 [0,0,0,1,0,0|3,0,0]=4 69 B10R1.18 N=C(N)CC1=CC=CC=C1 EB12037 [0,0,0,0,1,0|2,0,0]=3 70 B12R1.252 CC(C)NCCC1=CC=CC=C1 EB16351 [0,0,0,0,0,1|2,0,1]=4 71 B12R1.252 CC(C)NCCC1=CC=CC=C1 EB16415 [0,0,0,0,0,1|2,0,1]=4 72 B12R1.252 N=C(N)SCCC1=CC=CC=C1 EB33010 [0,0,0,0,0,1|2,1,0]=4 73 B11R1.16 CC(NC=O)C1=CC=CC=N1 EB60145 [1,1,0,0,0,0|2,0,0]=4 74 B11R1.16 CC(NC=O)C1=CC=CN=C1 EB60144 [1,1,0,0,0,0|2,0,0]=4 75 B11R1.16 CC(NC=O)C1=CC=NC=C1 EB60143 [1,1,0,0,0,0|2,0,0]=4 76 B11R1.20 CC1=CC=C(CC(=N)N)C=C1 EB12145 [0,1,0,0,1,0|2,0,0]=4 77 B11R1.20 CC1=CC=C(CC(=O)Cl)C=C1 EB15006 [0,1,0,0,1,0|1,0,0]=3 78 B11R1.20 N=C(N)CC1=CC=C(Br)C=C1 EB12082 [0,1,0,0,1,0|2,0,0]=4 79 B11R1.20 N=C(N)CC1=CC=C(Cl)C=C1 EB12038 [0,1,0,0,1,0|2,0,0]=4 80 B11R1.20 N=C(N)CC1=CC=C(F)C=C1 EB12040 [0,1,0,0,1,0|2,0,0]=4 81 B11R1.20 O=C(Cl)CC1=CC=C(Br)C=C1 EB15029 [0,1,0,0,1,0|1,0,0]=3 82 B11R1.86 CC1=C(CC(=N)N)C=CC=C1 EB12048 [0,1,0,0,1,0|2,0,0]=4 83 B11R1.86 CC1=CC=CC=C1CC(=O)Cl EB15014 [0,1,0,0,1,0|1,0,0]=3 84 B11R1.86 N=C(N)CC1=C(F)C=CC=C1 EB12046 [0,1,0,0,1,0|2,0,0]=4 85 B11R1.86 N=C(N)CC1=CC=CC=C1Cl EB12093 [0,1,0,0,1,0|2,0,0]=4 86 B11R1.157 CC1=CC(CC(=O)Cl)=CC=C1 EB15005 [0,1,0,0,1,0|1,0,0]=3 87 B11R1.157 CC1=CC=CC(CC(=N)N)=C1 EB12049 [0,1,0,0,1,0|2,0,0]=4 88 B11R1.157 N=C(N)CC1=CC=CC(Cl)=C1 EB12087 [0,1,0,0,1,0|2,0,0]=4 89 B11R1.157 O=C(Cl)CC1=CC(Cl)=CC=C1 EB15003 [0,1,0,0,1,0|1,0,0]=3 90 B13R1.351 NC(=O)C(N)CCC1=CC=CC=C1 EB61634 [0,1,0,0,0,1|2,0,0]=4 91 B13R1.351 NC(CCC1=CC=CC=C1)C(=O)O EB61627 [0,1,0,0,0,1|2,0,0]=4 92 B11R2.10 NC1=NC2=CC=CC=C2O1 EB33786 [0,0,0,1,1,0|2,0,0]=4 93 B11R2.10 SC1=NC2=CC=CC=C2O1 EB33761 [0,0,0,1,1,0|1,1,0]=4 94 B13R2.10 CC1=NC(C2=CC=CC=C2)=NO1 EB60088 [0,0,0,1,0,1|1,0,1]=4 95 B13R2.369 CN1CC2=CC=CC=C2CC1=O EB61759 [0,1,0,1,0,0|1,0,0]=3