0 B11R1.37 CC1=CN=C(C#N)C(C#N)=N1 SBB055882 [0,0,0,0,0,0|2,0,2]=4 1 B11R1.37 CCC1=C(CC)N=C(C)C=N1 SBB057797 [0,0,0,0,0,0|0,0,0]=0 2 B11R1.37 COC1=NC(C)=CC=C1C#N SBB072562 [0,0,0,0,0,0|3,0,1]=4 3 B11R1.37 CSC1=NC(C)=CC=C1C#N SBB087827 [0,0,0,0,0,0|3,0,1]=4 4 B10R1.20 CCC1=C(CC)N=CC=N1 SBB058452 [1,0,0,0,0,0|0,0,0]=1 5 B10R1.20 CNC1=NC=CC=C1CO SBB054793 [1,0,0,0,0,0|3,0,0]=4 6 B10R1.25 CC1=CC(C)=C(CCl)C=C1 SBB005790 [1,0,0,0,0,0|3,0,0]=4 7 B10R1.25 CCC1=C(C)C=C(C)C=C1 SBB061315 [1,0,0,0,0,0|2,0,0]=3 8 B10R1.25 CCC1=C(N)N=C(C)C=C1 SBB028253 [1,0,0,0,0,0|2,0,0]=3 9 B10R1.25 COC1=CC=C(C)C=C1C SBB061025 [1,0,0,0,0,0|3,0,0]=4 10 B10R1.25 COC1=NC=C(Br)C=C1C SBB054332 [1,0,0,0,0,0|3,0,0]=4 11 B10R1.30 CC1=CC(CCl)=C(C)C=C1 SBB040679 [1,0,0,0,0,0|3,0,0]=4 12 B10R1.30 CC1=CN=C(N)C(C#N)=N1 SBB055886 [1,0,0,0,0,0|2,0,1]=4 13 B10R1.30 CCC1=C(O)C=CC(C)=N1 SBB080737 [1,0,0,0,0,0|2,0,0]=3 14 B10R1.30 CCC1=NC(C)=CC=C1O SBB080762 [1,0,0,0,0,0|2,0,0]=3 15 B10R1.30 COC1=NC(Br)=CN=C1N SBB070417 [1,0,0,0,0,0|3,0,0]=4 16 B10R1.30 OCC1=C(O)C=CC(C)=N1 SBB004177 [1,0,0,0,0,0|3,0,0]=4 17 B12R1.78 CCC1=C(OC)C=CC(OC)=C1 SBB014717 [0,1,0,0,0,0|3,0,0]=4 18 B12R2.24 CC1=CC2=C(C=C1)NCCC2 SBB027083 [0,0,0,1,0,0|3,0,0]=4 19 B12R2.24 ClC1=CC2=C(C=C1)CCCC2 SBB060946 [0,0,0,1,0,0|3,0,0]=4 20 B12R2.24 NC1=CC2=C(C=C1)CCCC2 SBB013463 [0,0,0,1,0,0|3,0,0]=4 21 B12R2.24 NC1=NC=C2CCCCC2=N1 SBB027185 [0,0,0,1,0,0|3,0,0]=4 22 B10R1.32 CCN1N=C(C)C=C1CCl SBB073682 [0,0,0,0,1,0|2,0,0]=3 23 B10R1.32 CCN1N=C(C)C=C1CO SBB025140 [0,0,0,0,1,0|2,0,0]=3 24 B10R1.32 CCN1N=C(N)C=C1CO SBB073891 [0,0,0,0,1,0|3,0,0]=4 25 B10R1.32 CN1C=C(CO)C(CO)=N1 SBB073757 [0,0,0,0,1,0|3,0,0]=4 26 B10R1.257 CCC1=C(I)C=NN1CC SBB074013 [0,0,0,0,1,0|2,0,0]=3 27 B10R1.257 CCC1=NN=C(S)N1CC SBB030443 [0,0,0,0,1,0|3,0,0]=4 28 B10R1.257 CCN1N=CC(Br)=C1CN SBB022038 [0,0,0,0,1,0|3,0,0]=4 29 B10R1.257 CCN1N=CC(Br)=C1CO SBB073830 [0,0,0,0,1,0|3,0,0]=4 30 B10R1.257 CCN1N=CC(Cl)=C1CO SBB073831 [0,0,0,0,1,0|3,0,0]=4 31 B9R1.15 CC1=C(CBr)N=CC=C1 SBB021212 [2,0,0,0,0,0|2,0,0]=4 32 B9R1.15 CC1=CC=CN=C1CN SBB052454 [2,0,0,0,0,0|2,0,0]=4 33 B9R1.15 CCC1=CC=CC=C1C SBB061450 [2,0,0,0,0,0|2,0,0]=4 34 B9R1.15 COC1=NC=CN=C1N SBB051948 [2,0,0,0,0,0|2,0,0]=4 35 B9R1.15 CSC1=C(C)N=CC=N1 SBB008573 [2,0,0,0,0,0|1,0,0]=3 36 B9R1.1 CC1=CN=C(CN)C=N1 SBB052489 [2,0,0,0,0,0|1,0,0]=3 37 B9R1.1 CCC1=CC=C(C)N=C1 SBB060375 [2,0,0,0,0,0|1,0,0]=3 38 B9R1.1 COC1=CN=C(N)C=N1 SBB069821 [2,0,0,0,0,0|2,0,0]=4 39 B9R1.69 CC1=CC(C)=C(C)C=C1 SBB060396 [2,0,0,0,0,0|2,0,0]=4 40 B9R1.69 CC1=CN=C(Cl)C(C)=N1 SBB054473 [2,0,0,0,0,0|1,0,0]=3 41 B9R1.69 CC1=CN=C(N)C(Br)=N1 SBB054470 [2,0,0,0,0,0|2,0,0]=4 42 B9R1.69 CC1=NC(C)=C(C)C=C1 SBB061698 [2,0,0,0,0,0|1,0,0]=3 43 B9R1.69 CC1=NC(C)=C(N)C=C1 SBB013931 [2,0,0,0,0,0|2,0,0]=4 44 B9R1.69 CC1=NC(C)=C(O)C=C1 SBB013900 [2,0,0,0,0,0|2,0,0]=4 45 B9R1.69 CC1=NN=C(N)N=C1C SBB028209 [2,0,0,0,0,0|2,0,0]=4 46 B9R1.2 CC1=CC=CC(CBr)=N1 SBB070747 [2,0,0,0,0,0|2,0,0]=4 47 B9R1.2 CC1=CC=CC(CN)=N1 SBB079460 [2,0,0,0,0,0|2,0,0]=4 48 B9R1.2 CC1=CC=CC(CO)=N1 SBB065460 [2,0,0,0,0,0|2,0,0]=4 49 B9R1.2 CCC1=CC(C)=CC=C1 SBB061286 [2,0,0,0,0,0|2,0,0]=4 50 B9R1.2 CCC1=CC(C)=CC=C1 SBB061444 [2,0,0,0,0,0|2,0,0]=4 51 B9R1.2 CCC1=CN=CC(Br)=C1 SBB054407 [2,0,0,0,0,0|2,0,0]=4 52 B9R1.2 CCC1=NC(N)=CC=C1 SBB028205 [2,0,0,0,0,0|2,0,0]=4 53 B11R1.53 CCC1=NC=CN=C1C(C)=O SBB067086 [1,1,0,0,0,0|0,0,1]=3 54 B11R1.81 CCOC1=CC=C(C)C=C1C SBB061026 [1,1,0,0,0,0|2,0,0]=4 55 B11R1.166 CC1=CC(C)=C(C(C)N)C=C1 SBB020377 [1,1,0,0,0,0|2,0,0]=4 56 B11R1.167 CC1=CC=C(C)C(C(C)N)=C1 SBB009346 [1,1,0,0,0,0|2,0,0]=4 57 B11R1.182 CC1=CC(CCO)=C(C)C=C1 SBB005840 [1,1,0,0,0,0|2,0,0]=4 58 B11R1.183 CCCC1=C(CC)SC(N)=N1 SBB085474 [0,1,0,0,1,0|2,0,0]=4 59 B11R1.183 CCN1N=C(C)C=C1CC#N SBB073668 [0,1,0,0,1,0|1,0,1]=4 60 B11R1.64 CCC1=C(I)C=NN1C(C)C SBB074045 [0,1,0,0,1,0|2,0,0]=4 61 B11R1.303 CCN1N=CC(Br)=C1CNC SBB021955 [0,1,0,0,1,0|2,0,0]=4 62 B11R1.303 CCN1N=CC(Cl)=C1CNC SBB020593 [0,1,0,0,1,0|2,0,0]=4 63 B11R1.380 CCC1=C(C=O)C=NN1CC SBB025380 [0,1,0,0,1,0|1,0,1]=4 64 B11R1.380 CCC1=C(CN)C=NN1CC SBB026455 [0,1,0,0,1,0|1,0,0]=3 65 B11R2.1 CC1CCC2=NC=CN=C21 SBB057575 [1,0,0,1,0,0|0,0,0]=2 66 B11R2.1 OC1CCC2=C1C=CC=N2 SBB056373 [1,0,0,1,0,0|2,0,0]=4 67 B11R2.20 C1=CC2=C(C=C1)CCCC2 SBB060619 [1,0,0,1,0,0|2,0,0]=4 68 B11R2.10 NC1=NC2=C(CCCC2)S1 SBB000119 [0,0,0,1,1,0|2,0,0]=4 69 B11R2.10 NC1=NC2=C(CCCC2)S1 SBB006415 [0,0,0,1,1,0|2,0,0]=4 70 B13R2.57 CCC1=CC2=C(C=C1)CCCC2 SBB061515 [0,1,0,1,0,0|2,0,0]=4 71 B9R1.14 CCC1=CC=NN1CC SBB025387 [1,0,0,0,1,0|1,0,0]=3 72 B9R1.14 CCN1C=CN=C1CO SBB027204 [1,0,0,0,1,0|2,0,0]=4 73 B9R1.14 CCN1N=CC=C1CCl SBB025984 [1,0,0,0,1,0|2,0,0]=4 74 B9R1.14 CCN1N=CC=C1CN SBB004265 [1,0,0,0,1,0|2,0,0]=4 75 B9R1.14 CCN1N=CC=C1CO SBB025126 [1,0,0,0,1,0|2,0,0]=4 76 B9R1.14 N1C=C(CC)C(CC)=C1 SBB059631 [1,0,0,0,1,0|2,0,0]=4 77 B9R1.22 CC1=NC(C)=C(CO)S1 SBB054806 [1,0,0,0,1,0|2,0,0]=4 78 B9R1.22 CC1=NC(CO)=C(C)O1 SBB085678 [1,0,0,0,1,0|2,0,0]=4 79 B9R1.22 CC1=NN(C)C(CCl)=C1 SBB025118 [1,0,0,0,1,0|2,0,0]=4 80 B9R1.22 CC1=NN(C)C(CN)=C1 SBB004264 [1,0,0,0,1,0|2,0,0]=4 81 B9R1.22 CC1=NN(C)C(CO)=C1 SBB024986 [1,0,0,0,1,0|2,0,0]=4 82 B9R1.22 CC1=NN(C)C=C1CN SBB004263 [1,0,0,0,1,0|2,0,0]=4 83 B9R1.22 CC1=NN(C)C=C1CO SBB019670 [1,0,0,0,1,0|2,0,0]=4 84 B9R1.22 CCC1=C(C)SC(N)=N1 SBB085468 [1,0,0,0,1,0|2,0,0]=4 85 B9R1.22 CCN1N=C(C)C=C1C SBB024588 [1,0,0,0,1,0|2,0,0]=4 86 B9R1.132 CCN1N=CC(Br)=C1C SBB047364 [1,0,0,0,1,0|2,0,0]=4 87 B9R1.132 CCN1N=CC(C)=C1N SBB073537 [1,0,0,0,1,0|2,0,0]=4 88 B9R1.132 CCN1N=CC(Cl)=C1C SBB047363 [1,0,0,0,1,0|2,0,0]=4 89 B9R1.132 CCN1N=CC(I)=C1C SBB051460 [1,0,0,0,1,0|2,0,0]=4 90 B9R1.132 CCN1N=CC(N)=C1C SBB009355 [1,0,0,0,1,0|2,0,0]=4 91 B9R1.27 CC1=NNC(C)=C1CN SBB010243 [1,0,0,0,1,0|2,0,0]=4 92 B9R1.27 CC1=NOC(C)=C1CCl SBB004107 [1,0,0,0,1,0|2,0,0]=4 93 B9R1.27 CC1=NOC(C)=C1CN SBB046717 [1,0,0,0,1,0|2,0,0]=4 94 B9R1.27 CCC1=C(I)C=NN1C SBB073998 [1,0,0,0,1,0|2,0,0]=4 95 B9R1.27 CCC1=C(N)NN=C1C SBB010241 [1,0,0,0,1,0|2,0,0]=4 96 B9R1.27 N1C=C(C)C(CC)=C1C SBB004274 [1,0,0,0,1,0|0,0,1]=3