0 B10R1.61 CC(N)C1=C(Cl)C=CC=C1 ALBB-002134 [0,0,0,0,0,0|3,0,1]=4 1 B10R1.61 CC(O)C1=CC=CC=C1N ALBB-026300 [0,0,0,0,0,0|2,0,1]=3 2 B10R1.61 CC1=CC=CC=C1C(C)N ALBB-027087 [0,0,0,0,0,0|3,0,1]=4 3 B10R1.61 CC1=CN=CC=C1C(=O)O ALBB-031683 [0,0,0,0,0,0|2,0,0]=2 4 B10R1.61 CN(C)C1=C(N)C=CC=C1 ALBB-014704 [0,0,0,0,0,0|4,0,0]=4 5 B10R1.61 CN(C)C1=C(N)C=CC=C1 ALBB-014704 [0,0,0,0,0,0|4,0,0]=4 6 B10R1.61 N=C(N)C1=C(Cl)C=CC=C1 ALBB-031172 [0,0,0,0,0,0|3,0,0]=3 7 B10R1.61 NC1=C(C(=O)O)C=CN=C1 ALBB-008671 [0,0,0,0,0,0|2,0,0]=2 8 B10R1.61 O=C(Cl)C1=C(Cl)N=CC=C1 ALBB-016422 [0,0,0,0,0,0|3,0,0]=3 9 B10R1.61 O=C(O)C1=C(S)N=CC=C1 ALBB-005999 [0,0,0,0,0,0|1,1,0]=2 10 B10R1.61 OB(O)C1=C(F)C=CC=C1 ALBB-006127 [0,0,0,0,0,0|2,0,1]=3 11 B10R1.61 OB(O)C1=CC=CC=C1Cl ALBB-006098 [0,0,0,0,0,0|2,0,1]=3 12 B9R1.6 CC(N)C1=CC=CC=C1 ALBB-032928 [1,0,0,0,0,0|2,0,1]=4 13 B9R1.6 N=C(N)C1=CC=NC=C1 ALBB-031225 [1,0,0,0,0,0|3,0,0]=4 14 B9R1.6 NC(=S)C1=CC=NC=C1 ALBB-014817 [1,0,0,0,0,0|2,1,0]=4 15 B9R1.6 NC(=S)C1=CN=CC=C1 ALBB-014818 [1,0,0,0,0,0|2,1,0]=4 16 B9R1.6 OB(O)C1=CC=CN=C1 ALBB-006011 [1,0,0,0,0,0|2,0,1]=4 17 B9R1.15 CC1=C(NN)C=CC=C1 ALBB-005955 [1,0,0,0,0,0|3,0,0]=4 18 B9R1.15 CC1=C(NN)C=CC=C1 ALBB-005955 [1,0,0,0,0,0|3,0,0]=4 19 B9R1.15 CC1=CC=CC=C1CN ALBB-027035 [1,0,0,0,0,0|2,0,1]=4 20 B9R1.15 CNC1=CC=CC=C1N ALBB-012420 [1,0,0,0,0,0|3,0,0]=4 21 B9R1.15 CNC1=CC=CC=C1N ALBB-012420 [1,0,0,0,0,0|3,0,0]=4 22 B9R1.15 CSC1=C(N)C=CC=C1 ALBB-033047 [1,0,0,0,0,0|3,0,0]=4 23 B9R1.15 N#CC1=CC=CN=C1O ALBB-020186 [1,0,0,0,0,0|2,0,1]=4 24 B9R1.15 NC1=NC=CC=C1C=O ALBB-029924 [1,0,0,0,0,0|2,0,0]=3 25 B9R1.15 NCC1=C(N)C=CC=C1 ALBB-006006 [1,0,0,0,0,0|2,0,1]=4 26 B9R1.15 NNC1=C(F)C=CC=C1 ALBB-005977 [1,0,0,0,0,0|3,0,0]=4 27 B9R1.15 NNC1=CC=CC=C1Br ALBB-014120 [1,0,0,0,0,0|3,0,0]=4 28 B9R1.15 NNC1=CC=CC=C1Cl ALBB-005963 [1,0,0,0,0,0|3,0,0]=4 29 B9R1.15 O=CC1=CC=CN=C1Cl ALBB-028016 [1,0,0,0,0,0|2,0,0]=3 30 B9R1.15 O=CC1=CC=CNC1=O ALBB-022939 [1,0,0,0,0,0|1,0,1]=3 31 B9R1.15 OCC1=CC=CN=C1Cl ALBB-014837 [1,0,0,0,0,0|2,0,1]=4 32 B11R1.53 CCC1=CC=CC=C1B(O)O ALBB-011854 [0,1,0,0,0,0|2,0,1]=4 33 B11R1.53 CNC1=CC=CC=C1[N+](=O)[O-] ALBB-013492 [0,1,0,0,0,0|2,0,1]=4 34 B11R1.53 CNC1=NC=CC=C1C(=O)O ALBB-004269 [0,1,0,0,0,0|2,0,0]=3 35 B11R1.53 CSC1=CC=CC=C1C(=O)O ALBB-023339 [0,1,0,0,0,0|0,1,0]=2 36 B11R1.53 N#CC1=CC=CC=C1C(N)=O ALBB-032703 [0,1,0,0,0,0|2,0,0]=3 37 B11R1.53 NNC1=CC=CC=C1C(=O)O ALBB-003949 [0,1,0,0,0,0|1,0,0]=2 38 B11R1.53 NNC1=CC=CC=C1C(=O)O ALBB-003949 [0,1,0,0,0,0|1,0,0]=2 39 B11R1.53 O=CC1=C(B(O)O)C=CC=C1 ALBB-006095 [0,1,0,0,0,0|1,0,2]=4 40 B11R1.53 O=[IH2]C1=CC=CC=C1C(=O)O ALBB-030082 [0,1,0,0,0,0|0,0,1]=2 41 B11R1.87 NC1=CC=CC=C1S(N)(=O)=O ALBB-023260 [0,1,0,0,0,0|2,0,1]=4 42 B11R1.87 O=S(=O)(Cl)C1=C(Cl)C=CC=C1 ALBB-000997 [0,1,0,0,0,0|2,0,1]=4 43 B11R1.87 O=S(=O)(Cl)C1=C(F)C=CC=C1 ALBB-001001 [0,1,0,0,0,0|2,0,1]=4 44 B11R1.156 OB(O)C1=C(Cl)C=CC=C1Cl ALBB-011853 [0,1,0,0,0,0|2,0,1]=4 45 B11R1.159 NC1=C(C(=O)O)C=CC=C1Cl ALBB-025048 [0,1,0,0,0,0|1,0,0]=2 46 B11R1.159 NC1=C(C(=O)O)C=CC=C1O ALBB-024973 [0,1,0,0,0,0|1,0,0]=2 47 B11R1.159 O=[N+]([O-])C1=C(O)C(Cl)=NC=C1 ALBB-032813 [0,1,0,0,0,0|2,0,1]=4 48 B11R1.159 O=[N+]([O-])C1=CC=CC(O)=C1Cl ALBB-036426 [0,1,0,0,0,0|2,0,1]=4 49 B11R1.166 CC(C)C1=C(O)C=C(O)C=C1 ALBB-016128 [0,1,0,0,0,0|2,0,1]=4 50 B11R1.166 CC1=CC(=O)C(C(=O)O)=CN1 ALBB-026578 [0,1,0,0,0,0|1,0,1]=3 51 B11R1.166 CC1=CC(C)=C(C(=O)O)C=N1 ALBB-017532 [0,1,0,0,0,0|2,0,0]=3 52 B11R1.166 CC1=CC=C(C(=O)O)C(Cl)=N1 ALBB-005466 [0,1,0,0,0,0|2,0,0]=3 53 B11R1.166 CC1=NC(C)=C(C(=O)O)C=N1 ALBB-005392 [0,1,0,0,0,0|3,0,0]=4 54 B11R1.166 NC1=CC(N)=C([N+](=O)[O-])C=C1 ALBB-025768 [0,1,0,0,0,0|2,0,1]=4 55 B11R1.166 O=C(Cl)C1=CC=C(Cl)C=C1O ALBB-032119 [0,1,0,0,0,0|1,0,0]=2 56 B11R1.166 O=C1NC=C(C(=O)O)C(=O)N1 ALBB-025843 [0,1,0,0,0,0|2,0,1]=4 57 B11R1.166 OB(O)C1=C(F)C=C(F)C=C1 ALBB-006121 [0,1,0,0,0,0|2,0,1]=4 58 B11R1.167 CC(=O)C1=C(O)C=CC(F)=C1 ALBB-017940 [0,1,0,0,0,0|1,0,0]=2 59 B11R1.167 CC1=CC(C(=O)O)=C(N)C=C1 ALBB-006381 [0,1,0,0,0,0|1,0,0]=2 60 B11R1.167 CC1=CC=C(C)C(C(=O)Cl)=C1 ALBB-034794 [0,1,0,0,0,0|2,0,0]=3 61 B11R1.167 NC1=C(C(=O)O)C=C(F)C=C1 ALBB-006133 [0,1,0,0,0,0|1,0,0]=2 62 B11R1.167 O=C(O)C1=CC(I)=CN=C1O ALBB-034521 [0,1,0,0,0,0|1,0,0]=2 63 B11R1.167 O=[N+]([O-])C1=CC(O)=CC=C1O ALBB-024984 [0,1,0,0,0,0|1,0,1]=3 64 B11R1.167 O=[N+]([O-])C1=NC(Br)=CC=C1O ALBB-033958 [0,1,0,0,0,0|2,0,1]=4 65 B11R1.222 CC1=C(\C(N)=N\O)C=CC=C1 ALBB-014813 [0,1,0,0,0,0|2,0,0]=3 66 B11R1.222 CNC(=O)C1=C(Br)C=CC=C1 ALBB-018686 [0,1,0,0,0,0|2,0,0]=3 67 B11R1.222 CNC(=O)C1=C(O)C=CC=C1 ALBB-024721 [0,1,0,0,0,0|1,0,0]=2 68 B11R1.222 COC(=O)C1=CC=CN=C1N ALBB-030657 [0,1,0,0,0,0|2,0,0]=3 69 B11R1.222 COC(=O)C1=CC=CNC1=O ALBB-034118 [0,1,0,0,0,0|1,0,1]=3 70 B11R1.222 NNC(=O)C1=C(Br)C=CC=C1 ALBB-030168 [0,1,0,0,0,0|2,0,0]=3 71 B11R1.222 NNC(=O)C1=CC=CC=C1I ALBB-001064 [0,1,0,0,0,0|2,0,0]=3 72 B11R1.222 O=C(CBr)C1=C(Cl)C=CC=C1 ALBB-021379 [0,1,0,0,0,0|2,0,0]=3 73 B11R2.1 CC1=NNC2=CC=CC=C21 ALBB-018700 [0,0,0,1,0,0|3,0,0]=4 74 B11R2.1 CC1=NNC2=CC=CC=C21 ALBB-018700 [0,0,0,1,0,0|3,0,0]=4 75 B11R2.1 NC1=NNC2=C1C=CC=C2 ALBB-028239 [0,0,0,1,0,0|3,0,0]=4 76 B11R2.1 NC1=NOC2=CC=CC=C21 ALBB-006860 [0,0,0,1,0,0|2,0,0]=3 77 B11R2.1 O=C1NCC2=CC=CC=C12 ALBB-012842 [0,0,0,1,0,0|2,0,0]=3 78 B11R2.1 ON1N=NC2=CC=CC=C21 ALBB-013485 [0,0,0,1,0,0|3,0,0]=4 79 B9R1.41 CC1=C(C(=O)O)C=CO1 ALBB-023547 [0,0,0,0,1,0|2,0,0]=3 80 B9R1.41 CC1=C(C(=O)O)C=NN1 ALBB-005391 [0,0,0,0,1,0|3,0,0]=4 81 B9R1.41 CC1=C(C(=O)O)C=NO1 ALBB-005390 [0,0,0,0,1,0|3,0,0]=4 82 B9R1.41 CC1=C(C(=O)O)NC=N1 ALBB-011929 [0,0,0,0,1,0|3,0,0]=4 83 B9R1.41 CC1=C(C(=O)O)SC=C1 ALBB-005998 [0,0,0,0,1,0|2,0,0]=3 84 B9R1.41 CC1=C(C(=O)O)SC=N1 ALBB-016438 [0,0,0,0,1,0|3,0,0]=4 85 B9R1.41 CN1C=CC=C1C(=O)O ALBB-019244 [0,0,0,0,1,0|2,0,0]=3 86 B9R1.41 CN1C=CN=C1C(=O)O ALBB-026373 [0,0,0,0,1,0|3,0,0]=4 87 B9R1.41 CN1C=NC=C1C(=O)O ALBB-014972 [0,0,0,0,1,0|3,0,0]=4 88 B9R1.41 CN1N=CC=C1C(=O)O ALBB-000283 [0,0,0,0,1,0|3,0,0]=4 89 B9R1.41 NC(=O)C1=C(N)SC=C1 ALBB-000271 [0,0,0,0,1,0|3,0,0]=4 90 B9R1.41 NC1=C(C(=O)O)C=NN1 ALBB-005479 [0,0,0,0,1,0|3,0,0]=4 91 B9R1.41 NC1=C(C(=O)[O-])SC=C1 ALBB-014295 [0,0,0,0,1,0|2,0,1]=4 92 B9R1.41 O=C(O)C1=C(I)C=NN1 ALBB-003732 [0,0,0,0,1,0|3,0,0]=4 93 B11R1.86 CC(=O)NC1=C(N)C=CC=C1 ALBB-006008 [0,0,0,0,0,1|2,0,0]=3 94 B11R1.86 CC(=O)NC1=NC=CC=C1O ALBB-005866 [0,0,0,0,0,1|2,0,0]=3 95 B11R1.86 CC1=C(CC(=O)Cl)C=CC=C1 ALBB-031004 [0,0,0,0,0,1|2,0,0]=3 96 B11R1.86 NC(=O)CC1=CC=CC=C1O ALBB-026230 [0,0,0,0,0,1|1,0,0]=2 97 B8R1.2 OCC1=CC=NC=C1 ALBB-021945 [2,0,0,0,0,0|1,0,1]=4 98 B8R1.5 NC1=CC=CN=C1O ALBB-027684 [2,0,0,0,0,0|2,0,0]=4 99 B8R1.5 NC1=CNC=CC1=O ALBB-035693 [2,0,0,0,0,0|2,0,0]=4 100 B8R1.5 OC1=C(I)C=CN=C1 ALBB-033911 [2,0,0,0,0,0|2,0,0]=4 101 B8R1.5 OC1=CC=CN=C1Br ALBB-008720 [2,0,0,0,0,0|2,0,0]=4 102 B10R1.13 CC(O)C1=CC=C(Br)C=C1 ALBB-026428 [1,1,0,0,0,0|1,0,1]=4 103 B10R1.13 CC1=CC=C(C(=O)O)C=N1 ALBB-016354 [1,1,0,0,0,0|1,0,0]=3 104 B10R1.13 CC1=CC=C(S(=O)[O-])C=C1 ALBB-026935 [1,1,0,0,0,0|1,0,1]=4 105 B10R1.13 N=C(N)C1=CC=C(Cl)C=C1 ALBB-006572 [1,1,0,0,0,0|2,0,0]=4 106 B10R1.13 N=C(N)C1=CC=C(Cl)C=C1 ALBB-006572 [1,1,0,0,0,0|2,0,0]=4 107 B10R1.13 NC(=O)C1=CC=C(Cl)N=C1 ALBB-023898 [1,1,0,0,0,0|2,0,0]=4 108 B10R1.13 NC1=NC=C(C(=O)O)C=C1 ALBB-005967 [1,1,0,0,0,0|1,0,0]=3 109 B10R1.13 O=C(O)C1=CC=C(Cl)N=N1 ALBB-012419 [1,1,0,0,0,0|2,0,0]=4 110 B10R1.13 O=C1C=CC(C(=O)O)=CO1 ALBB-033465 [1,1,0,0,0,0|1,0,0]=3 111 B10R1.13 O=C1C=CC(C(=O)O)=NN1 ALBB-005625 [1,1,0,0,0,0|2,0,0]=4 112 B10R1.13 OB(O)C1=CC=C(Cl)C=C1 ALBB-006093 [1,1,0,0,0,0|1,0,1]=4 113 B10R1.13 OB(O)C1=CC=C(F)C=C1 ALBB-006109 [1,1,0,0,0,0|1,0,1]=4 114 B10R1.15 COC(=N)C1=CC=CC=C1 ALBB-033150 [1,1,0,0,0,0|1,0,0]=3 115 B10R1.15 COC(=N)C1=CC=CC=N1 ALBB-033273 [1,1,0,0,0,0|2,0,0]=4 116 B10R1.15 COC(=N)C1=CC=CN=C1 ALBB-033274 [1,1,0,0,0,0|2,0,0]=4 117 B10R1.15 COC(=N)C1=CC=NC=C1 ALBB-033275 [1,1,0,0,0,0|2,0,0]=4 118 B10R1.15 COC(=O)C1=NC=CN=C1 ALBB-014717 [1,1,0,0,0,0|2,0,0]=4 119 B10R1.15 NNC(=O)C1=CC=CC=N1 ALBB-001060 [1,1,0,0,0,0|2,0,0]=4 120 B10R1.15 NNC(=O)C1=CN=CC=C1 ALBB-025730 [1,1,0,0,0,0|2,0,0]=4 121 B10R1.15 N\C(=N/O)C1=CC=CC=C1 ALBB-014807 [1,1,0,0,0,0|1,0,0]=3 122 B10R1.15 N\C(=N/O)C1=CC=NC=C1 ALBB-014810 [1,1,0,0,0,0|2,0,0]=4 123 B10R1.15 N\C(=N/O)C1=CN=CC=C1 ALBB-014809 [1,1,0,0,0,0|2,0,0]=4 124 B10R1.15 N\C(=N/O)C1=NC=CC=C1 ALBB-014808 [1,1,0,0,0,0|2,0,0]=4 125 B10R1.15 OC(CBr)C1=CC=CC=C1 ALBB-030701 [1,1,0,0,0,0|1,0,1]=4 126 B10R1.113 NC(=O)C1=CC(Cl)=NC=C1 ALBB-016300 [1,1,0,0,0,0|2,0,0]=4 127 B10R1.113 NC(=O)C1=NC(Cl)=CC=C1 ALBB-022380 [1,1,0,0,0,0|2,0,0]=4 128 B10R1.113 NC1=CC(B(O)O)=CC=C1 ALBB-006090 [1,1,0,0,0,0|1,0,1]=4 129 B10R1.113 NC1=CC(B(O)O)=CC=C1 ALBB-006090 [1,1,0,0,0,0|1,0,1]=4 130 B10R1.113 NC1=CC(C(=O)O)=NC=C1 ALBB-030554 [1,1,0,0,0,0|1,0,0]=3 131 B10R1.113 O=C(Cl)C1=CC=NC(Cl)=C1 ALBB-028821 [1,1,0,0,0,0|2,0,0]=4 132 B10R1.113 O=C(O)C1=NC(Br)=CC=C1 ALBB-022487 [1,1,0,0,0,0|1,0,0]=3 133 B10R1.113 O=C(O)C1=NC=CC(Cl)=C1 ALBB-017976 [1,1,0,0,0,0|1,0,0]=3 134 B10R1.113 OB(O)C1=CC=CC(Cl)=C1 ALBB-006092 [1,1,0,0,0,0|1,0,1]=4 135 B10R1.113 OB(O)C1=CC=CC(F)=C1 ALBB-006113 [1,1,0,0,0,0|1,0,1]=4 136 B10R1.2 OCC1=CC=CC(F)=C1F ALBB-030139 [1,1,0,0,0,0|1,0,1]=4 137 B10R1.4 CC1=CC=CC=C1N=S=O ALBB-026544 [1,1,0,0,0,0|2,0,0]=4 138 B10R1.4 O=C=NC1=CC=CC=C1Br ALBB-003015 [1,1,0,0,0,0|1,0,1]=4 139 B10R1.4 O=C=NC1=CC=CC=C1F ALBB-007535 [1,1,0,0,0,0|1,0,1]=4 140 B10R1.4 O=S=NC1=CC=CC=C1Cl ALBB-026529 [1,1,0,0,0,0|2,0,0]=4 141 B10R1.4 O=S=NC1=CC=CC=C1F ALBB-026555 [1,1,0,0,0,0|2,0,0]=4 142 B10R1.20 COC1=C(NN)C=CC=C1 ALBB-005956 [1,1,0,0,0,0|2,0,0]=4 143 B10R1.20 N#CC1=C(C=O)C=CC=C1 ALBB-017978 [1,1,0,0,0,0|1,0,0]=3 144 B10R1.20 NCC1=C(CO)C=CC=C1 ALBB-032174 [1,1,0,0,0,0|1,0,1]=4 145 B10R1.25 COC1=C(O)C=C(O)C=C1 ALBB-013787 [1,1,0,0,0,0|2,0,0]=4 146 B10R1.30 N#CC1=CC(N)=CC=C1O ALBB-026309 [1,1,0,0,0,0|1,0,1]=4 147 B10R1.59 CC1=CC(C(=O)O)=C(C)O1 ALBB-000792 [0,1,0,0,1,0|2,0,0]=4 148 B10R1.149 COC(=O)C1=C(N)SC=C1 ALBB-002018 [0,1,0,0,1,0|2,0,0]=4 149 B10R1.194 CC1=C(C(=O)O)C=CN1C ALBB-021978 [0,1,0,0,1,0|2,0,0]=4 150 B10R1.194 CC1=CC=C(C(=O)O)N1C ALBB-032917 [0,1,0,0,1,0|2,0,0]=4 151 B12R1.75 CC(=O)NC1=CC=CC=C1C#N ALBB-023923 [0,1,0,0,0,1|2,0,0]=4 152 B12R1.127 CC(=O)NC1=C(N)C=CC(C)=C1 ALBB-017767 [0,1,0,0,0,1|2,0,0]=4 153 B12R1.127 CC(=O)NC1=C(O)C=CC(C)=C1 ALBB-035710 [0,1,0,0,0,1|1,0,0]=3 154 B12R1.127 CC(=O)NC1=C(O)C=CC(Cl)=C1 ALBB-035550 [0,1,0,0,0,1|1,0,0]=3 155 B12R1.224 CC(=O)NC1=C(O)C(Cl)=CC=C1 ALBB-010442 [0,1,0,0,0,1|1,0,0]=3 156 B12R1.224 CC(=O)NC1=CC=CC(Cl)=C1C ALBB-020408 [0,1,0,0,0,1|2,0,0]=4 157 B12R1.233 CC(=O)NC1=C(Cl)C=C(Cl)C=C1 ALBB-035035 [0,1,0,0,0,1|2,0,0]=4 158 B12R1.233 CC(=O)NC1=C(N)C=C(C)C=C1 ALBB-010363 [0,1,0,0,0,1|2,0,0]=4 159 B12R1.233 CC(=O)NC1=CC=C(C)C=C1O ALBB-005865 [0,1,0,0,0,1|1,0,0]=3 160 B12R1.233 CC(=O)NC1=CC=C(O)C=C1C ALBB-033428 [0,1,0,0,0,1|2,0,0]=4 161 B12R1.233 CC1=NC(O)=C(CC(=O)O)C=N1 ALBB-018565 [0,1,0,0,0,1|2,0,0]=4 162 B12R1.371 CC1=C(CC(=O)NN)C=CC=C1 ALBB-031003 [0,1,0,0,0,1|2,0,0]=4 163 B12R1.371 CC1=C(NC(=O)CBr)C=CC=C1 ALBB-010529 [0,1,0,0,0,1|2,0,0]=4 164 B12R1.371 CC1=CC=CC=C1NC(=O)CCl ALBB-002260 [0,1,0,0,0,1|2,0,0]=4 165 B12R1.371 NNC(=O)CC1=C(Cl)C=CC=C1 ALBB-002696 [0,1,0,0,0,1|2,0,0]=4 166 B12R1.371 NNC(=O)NC1=C(O)C=CC=C1 ALBB-033792 [0,1,0,0,0,1|1,0,0]=3 167 B12R1.371 O=C(CBr)NC1=C(Cl)C=CC=C1 ALBB-010555 [0,1,0,0,0,1|2,0,0]=4 168 B12R1.371 O=C(CBr)NC1=CC=CC=C1F ALBB-031587 [0,1,0,0,0,1|2,0,0]=4 169 B12R1.371 O=C(CCl)NC1=CC=CC=C1Br ALBB-002399 [0,1,0,0,0,1|2,0,0]=4 170 B12R1.371 O=C(CCl)NC1=CC=CC=C1Cl ALBB-002252 [0,1,0,0,0,1|2,0,0]=4 171 B12R1.371 O=C(CCl)NC1=CC=CC=C1F ALBB-002251 [0,1,0,0,0,1|2,0,0]=4 172 B12R1.371 O=C(CCl)NC1=CC=CC=C1I ALBB-019143 [0,1,0,0,0,1|2,0,0]=4 173 B12R1.371 O=C(CCl)NC1=CC=CC=C1O ALBB-024846 [0,1,0,0,0,1|1,0,0]=3 174 B12R1.371 O=C(CS)NC1=C(Cl)C=CC=C1 ALBB-017014 [0,1,0,0,0,1|1,1,0]=4 175 B12R1.1009 NC(=O)CC1=C(Cl)C=CC=C1Cl ALBB-034092 [0,1,0,0,0,1|2,0,0]=4 176 B12R1.46 COC1=C(B(O)O)C=C(F)C=C1 ALBB-006118 [0,2,0,0,0,0|1,0,1]=4 177 B12R1.46 COC1=C(C(=O)O)C=C(Br)C=C1 ALBB-023276 [0,2,0,0,0,0|0,0,0]=2 178 B12R1.46 COC1=C(C(C)=O)C=C(F)C=C1 ALBB-004400 [0,2,0,0,0,0|1,0,0]=3 179 B12R1.77 CNC(=O)C1=C(CO)C=CC=C1 ALBB-023845 [0,2,0,0,0,0|1,0,0]=3 180 B12R1.77 COC(=O)C1=C(SC)C=CC=C1 ALBB-024142 [0,2,0,0,0,0|0,1,0]=3 181 B12R1.77 COC(=O)C1=CC=CC=C1CBr ALBB-018007 [0,2,0,0,0,0|1,0,0]=3 182 B12R1.77 NNC(=O)C1=CC=CC=C1CO ALBB-025729 [0,2,0,0,0,0|1,0,0]=3 183 B12R1.87 COC1=C(C(=O)O)C=CC=C1C ALBB-025586 [0,2,0,0,0,0|0,0,0]=2 184 B12R1.261 CS(=O)C1=CC=CC=C1B(O)O ALBB-006129 [0,2,0,0,0,0|2,0,0]=4 185 B12R1.261 O=C(O)C1=C(B(O)O)C=CC=C1 ALBB-006115 [0,2,0,0,0,0|0,0,0]=2 186 B12R1.283 CCOC1=CC=CC=C1B(O)O ALBB-006099 [0,2,0,0,0,0|1,0,1]=4 187 B12R1.283 CCOC1=CC=CC=C1C(C)=O ALBB-002912 [0,2,0,0,0,0|1,0,0]=3 188 B12R1.283 CCSC1=C(C(=O)O)C=CC=C1 ALBB-009419 [0,2,0,0,0,0|0,1,0]=3 189 B12R1.128 NC1=CC(S(=O)(=O)O)=C(N)C=C1 ALBB-025573 [0,2,0,0,0,0|2,0,0]=4 190 B12R1.1000 CC(=O)C1=C(C)C=C(C)C=C1C ALBB-022477 [0,2,0,0,0,0|2,0,0]=4 191 B12R1.1000 CC(=O)C1=C(O)C=C(O)C=C1O ALBB-015674 [0,2,0,0,0,0|1,0,0]=3 192 B12R1.1000 CC1=CC(C)=C(C(=O)O)C(=O)N1 ALBB-031238 [0,2,0,0,0,0|1,0,1]=4 193 B12R1.3441 NNC(=O)C1=C(O)C=CC=C1O ALBB-036475 [0,2,0,0,0,0|1,0,0]=3 194 B12R1.24 CC1=C(O)C(C(=O)NN)=CC=C1 ALBB-002673 [0,2,0,0,0,0|1,0,0]=3 195 B12R1.24 COC(=O)C1=C(C)C(N)=CC=C1 ALBB-023509 [0,2,0,0,0,0|1,0,0]=3 196 B12R1.24 COC(=O)C1=C(O)C(C)=CC=C1 ALBB-023189 [0,2,0,0,0,0|0,0,0]=2 197 B12R1.24 NNC(=O)C1=CC=CC(Cl)=C1Cl ALBB-002670 [0,2,0,0,0,0|2,0,0]=4 198 B12R1.511 NC1=C(I)C=C(I)C=C1C(=O)O ALBB-026465 [0,2,0,0,0,0|1,0,0]=3 199 B12R1.511 O=C(O)C1=C(Cl)C(Br)=CC(Br)=C1 ALBB-013004 [0,2,0,0,0,0|1,0,0]=3 200 B12R1.511 O=C(O)C1=C(I)C(I)=CC(I)=C1 ALBB-017941 [0,2,0,0,0,0|1,0,0]=3 201 B12R1.511 O=C(O)C1=C(O)C(Br)=CC(Cl)=C1 ALBB-036488 [0,2,0,0,0,0|0,0,0]=2 202 B12R1.893 CC(=O)C1=CC=C(O)C(O)=C1O ALBB-015601 [0,2,0,0,0,0|1,0,0]=3 203 B12R1.893 CC1=C(O)C=CC(C(=O)O)=C1O ALBB-035120 [0,2,0,0,0,0|0,0,0]=2 204 B12R1.232 CC(=O)C1=C(C)C=C(C)C(C)=C1 ALBB-005962 [0,2,0,0,0,0|2,0,0]=4 205 B12R1.232 CC1=CC(=O)C(C(=O)O)=CN1C ALBB-026579 [0,2,0,0,0,0|1,0,1]=4 206 B12R1.452 COC1=CC(O)=C([N+](=O)[O-])C=C1 ALBB-013791 [0,2,0,0,0,0|1,0,1]=4 207 B12R1.452 COC1=CC=C(C(=O)O)C(O)=C1 ALBB-032509 [0,2,0,0,0,0|0,0,0]=2 208 B12R1.1703 CC1=CC(Cl)=C(C(=O)NN)C=C1 ALBB-026175 [0,2,0,0,0,0|2,0,0]=4 209 B12R1.1703 CC1=CC=C(C(=O)NN)C(O)=C1 ALBB-032817 [0,2,0,0,0,0|1,0,0]=3 210 B12R1.1703 COC(=O)C1=C(C)C=C(Br)C=C1 ALBB-027290 [0,2,0,0,0,0|1,0,0]=3 211 B12R1.1703 COC(=O)C1=C(O)C=C(Cl)C=C1 ALBB-031593 [0,2,0,0,0,0|0,0,0]=2 212 B12R1.1703 COC(=O)C1=NC=C(Cl)C=C1Cl ALBB-036471 [0,2,0,0,0,0|2,0,0]=4 213 B12R1.1703 C\C(=N/O)C1=CC=C(O)C=C1O ALBB-005296 [0,2,0,0,0,0|1,0,0]=3 214 B12R1.1703 NNC(=O)C1=CC=C(Cl)C=C1O ALBB-002674 [0,2,0,0,0,0|1,0,0]=3 215 B12R1.1703 NNC(=O)C1=CC=C(O)C=C1O ALBB-002499 [0,2,0,0,0,0|1,0,0]=3 216 B12R1.354 CC1=CC=C(O)C(C(=O)CCl)=C1 ALBB-023725 [0,2,0,0,0,0|1,0,0]=3 217 B12R1.354 CC1=CC=C(O)C(C(=O)NN)=C1 ALBB-032128 [0,2,0,0,0,0|1,0,0]=3 218 B12R1.354 CCC(=O)C1=CC(C)=CC=C1C ALBB-002888 [0,2,0,0,0,0|2,0,0]=4 219 B12R1.354 COC(=O)C1=C(N)C=CC(I)=C1 ALBB-023799 [0,2,0,0,0,0|1,0,0]=3 220 B12R1.354 COC(=O)C1=CC(Br)=CC=C1O ALBB-022631 [0,2,0,0,0,0|0,0,0]=2 221 B12R1.354 COC(=O)C1=CC(C)=CC=C1O ALBB-032127 [0,2,0,0,0,0|0,0,0]=2 222 B12R1.354 NNC(=O)C1=C(Cl)C=CC(I)=C1 ALBB-032700 [0,2,0,0,0,0|2,0,0]=4 223 B12R1.354 NNC(=O)C1=CC(Br)=CC=C1Cl ALBB-002668 [0,2,0,0,0,0|2,0,0]=4 224 B12R1.354 NNC(=O)C1=CC(Br)=CC=C1O ALBB-002515 [0,2,0,0,0,0|1,0,0]=3 225 B12R1.354 NNC(=O)C1=CC(Cl)=CC=C1O ALBB-002516 [0,2,0,0,0,0|1,0,0]=3 226 B12R1.354 NNC(=O)C1=CC(O)=CC=C1O ALBB-002500 [0,2,0,0,0,0|1,0,0]=3 227 B12R1.354 O=C(CCl)C1=CC(Cl)=CC=C1O ALBB-025562 [0,2,0,0,0,0|1,0,0]=3 228 B12R1.453 CCC1=CC([N+](=O)[O-])=C(O)C=C1 ALBB-025877 [0,2,0,0,0,0|1,0,1]=4 229 B12R1.453 CSC1=CC(C(=O)O)=C(Cl)C=C1 ALBB-031646 [0,2,0,0,0,0|1,0,0]=3 230 B12R1.453 O=CC1=CC(C(=O)O)=C(O)C=C1 ALBB-018293 [0,2,0,0,0,0|0,0,0]=2 231 B12R1.308 CCNC(=O)C1=C(O)C=CC=C1 ALBB-023496 [0,2,0,0,0,0|1,0,0]=3 232 B12R1.308 CCOC(=N)C1=C(C)C=CC=C1 ALBB-033229 [0,2,0,0,0,0|2,0,0]=4 233 B12R1.308 CCOC(=O)C1=C(O)N=CN=C1 ALBB-017345 [0,2,0,0,0,0|2,0,0]=4 234 B12R1.308 N#CCC(=O)C1=CC=CC=C1Cl ALBB-027424 [0,2,0,0,0,0|2,0,0]=4 235 B10R1.66 O=C(Cl)\C=C\C1=CC=CS1 ALBB-011741 [0,0,1,1,0,0|1,1,0]=4 236 B10R1.66 O=C(O)\C=C\C1=CC=CO1 ALBB-011720 [0,0,1,1,0,0|0,0,0]=2 237 B10R1.66 O=C(O)\C=C\C1=CC=CS1 ALBB-011721 [0,0,1,1,0,0|0,1,0]=3 238 B10R1.66 O=C(O)\C=C\C1=CNC=N1 ALBB-025618 [0,0,1,1,0,0|2,0,0]=4 239 B10R1.66 O=C(O)\C=C\C1=CNC=N1 ALBB-025618 [0,0,1,1,0,0|2,0,0]=4 240 B10R1.66 O=C([O-])\C=C\C1=CC=CO1 ALBB-011720 [0,0,1,1,0,0|0,0,1]=3 241 B10R1.66 O=[N+]([O-])\C=C\C1=CC=CO1 ALBB-021193 [0,0,1,1,0,0|1,0,1]=4 242 B12R2.24 O=C1C=NC2=CC=CC=C2N1 ALBB-024162 [0,0,0,1,0,1|2,0,0]=4 243 B12R2.24 O=C1CNC2=CC=CC=C2N1 ALBB-006577 [0,0,0,1,0,1|2,0,0]=4 244 B12R2.24 O=C1COC2=CC=CC=C2N1 ALBB-020505 [0,0,0,1,0,1|1,0,0]=3 245 B12R2.24 OC1=CC2=C(C=CC=C2)N=C1 ALBB-021965 [0,0,0,1,0,1|2,0,0]=4 246 B12R2.202 CC1=C2NC(=O)CC2=CC=C1 ALBB-014697 [0,0,0,1,0,1|2,0,0]=4 247 B12R2.1081 O=C1CCOC2=CC=CC=C12 ALBB-019685 [0,1,0,1,0,0|1,0,0]=3 248 B12R2.1081 O=C1CCSC2=C1C=CC=C2 ALBB-021273 [0,1,0,1,0,0|1,1,0]=4 249 B12R2.1081 O=C1NC=CC2=CC=CC=C12 ALBB-023588 [0,1,0,1,0,0|2,0,0]=4 250 B12R2.1081 O=C1NC=NC2=CC=CC=C12 ALBB-012761 [0,1,0,1,0,0|2,0,0]=4 251 B12R2.1081 O=C1NN=CC2=C1C=CC=C2 ALBB-028398 [0,1,0,1,0,0|2,0,0]=4 252 B12R2.1081 OC1=CC=NC2=CC=CC=C12 ALBB-019954 [0,1,0,1,0,0|2,0,0]=4 253 B12R2.1081 OC1=CN=NC2=CC=CC=C12 ALBB-019489 [0,1,0,1,0,0|2,0,0]=4 254 B12R2.612 NC1=CC=C2C(=O)OCC2=C1 ALBB-025001 [0,1,0,1,0,0|1,0,0]=3 255 B8R1.7 CC(=O)C1=CSC=C1 ALBB-005994 [1,0,0,0,1,0|2,0,0]=4 256 B8R1.7 O=C(O)C1=CN=CS1 ALBB-013700 [1,0,0,0,1,0|2,0,0]=4 257 B8R1.7 O=C(O)C1=CNC=N1 ALBB-025706 [1,0,0,0,1,0|2,0,0]=4 258 B8R1.7 O=C(O)C1=COC=C1 ALBB-005990 [1,0,0,0,1,0|1,0,0]=3 259 B8R1.7 O=C(O)C1=CSC=C1 ALBB-012106 [1,0,0,0,1,0|1,0,0]=3 260 B8R1.7 O=C(O)C1=NNC=C1 ALBB-006075 [1,0,0,0,1,0|2,0,0]=4 261 B12R1.125 CC(=O)C#CC1=CC=CC=C1C ALBB-029861 [0,0,0,0,0,2|2,0,0]=4 262 B12R1.125 CC(=O)COC1=C(Cl)C=CC=C1 ALBB-035766 [0,0,0,0,0,2|2,0,0]=4 263 B12R1.125 CC1=C(SCC(=O)O)C=CC=C1 ALBB-031682 [0,0,0,0,0,2|1,0,0]=3 264 B12R1.125 CC1=C(\C=C\C(=O)O)C=CC=C1 ALBB-007550 [0,0,0,0,0,2|1,0,0]=3 265 B12R1.125 CC1=CC=CC=C1NCC(=O)O ALBB-003985 [0,0,0,0,0,2|1,0,0]=3 266 B12R1.125 CC1=CC=CC=C1OCC(=O)Cl ALBB-011202 [0,0,0,0,0,2|2,0,0]=4 267 B12R1.125 CC1=CC=CC=C1OCC(=O)O ALBB-000800 [0,0,0,0,0,2|1,0,0]=3 268 B12R1.125 CC1=CC=CC=C1\C=C\C(=O)Cl ALBB-011765 [0,0,0,0,0,2|2,0,0]=4 269 B12R1.125 O=C(Cl)COC1=C(Cl)C=CC=C1 ALBB-011209 [0,0,0,0,0,2|2,0,0]=4 270 B12R1.125 O=C(Cl)COC1=CC=CC=C1Br ALBB-011218 [0,0,0,0,0,2|2,0,0]=4 271 B12R1.125 O=C(Cl)\C=C\C1=CC=CC=C1Br ALBB-011763 [0,0,0,0,0,2|2,0,0]=4 272 B12R1.125 O=C(Cl)\C=C\C1=CC=CC=C1F ALBB-011760 [0,0,0,0,0,2|2,0,0]=4 273 B12R1.125 O=C(O)CCC1=C(F)C=CC=C1 ALBB-023257 [0,0,0,0,0,2|1,0,0]=3 274 B12R1.125 O=C(O)CCN1C=CC=CC1=O ALBB-017893 [0,0,0,0,0,2|1,0,1]=4 275 B12R1.125 O=C(O)CNC1=C(Cl)C=CC=C1 ALBB-027317 [0,0,0,0,0,2|1,0,0]=3 276 B12R1.125 O=C(O)COC1=C(Cl)C=CC=C1 ALBB-000807 [0,0,0,0,0,2|1,0,0]=3 277 B12R1.125 O=C(O)COC1=CC=CC=C1Br ALBB-000818 [0,0,0,0,0,2|1,0,0]=3 278 B12R1.125 O=C(O)COC1=CC=CC=C1F ALBB-000256 [0,0,0,0,0,2|1,0,0]=3 279 B12R1.125 O=C(O)\C=C\C1=CC=CC=C1Br ALBB-011738 [0,0,0,0,0,2|1,0,0]=3 280 B12R1.125 O=C(O)\C=C\C1=CC=CC=C1Cl ALBB-006017 [0,0,0,0,0,2|1,0,0]=3 281 B12R1.125 O=C(O)\C=C\C1=CC=CC=C1F ALBB-011736 [0,0,0,0,0,2|1,0,0]=3 282 B12R1.125 O=C(O)\C=C\C1=CC=CC=C1O ALBB-025832 [0,0,0,0,0,2|0,0,0]=2