0 B13R2.3028 CC1=C(C)C2=CC(Br)=CC=C2N1 ALBB-030056 [0,0,0,0,0,0|3,1,0]=4 1 B13R2.3028 CC1=C(C)C2=CC(F)=CC=C2N1 ALBB-030055 [0,0,0,0,0,0|3,0,0]=3 2 B13R2.3028 CC1=CC=C2NC(=O)C(=O)C2=C1 ALBB-014097 [0,0,0,0,0,0|2,0,1]=3 3 B13R2.3028 NC1C(=O)NC2=CC=C(F)C=C21 ALBB-022603 [0,0,0,0,0,0|2,0,0]=2 4 B13R2.3028 O=C1NC2=C(C=C(F)C=C2)C1=O ALBB-002980 [0,0,0,0,0,0|1,0,1]=2 5 B12R2.18 CN1C(N)=NC2=C1C=CC=C2 ALBB-009345 [1,0,0,0,0,0|2,0,1]=4 6 B12R2.18 CN1C2=CC=CC=C2N=C1S ALBB-017608 [1,0,0,0,0,0|1,1,1]=4 7 B12R2.606 CC1=CC2=C(C=C1)NC(S)=N2 ALBB-012662 [1,0,0,0,0,0|1,1,1]=4 8 B12R2.606 CC1=CC2=C(C=CC(Cl)=C2)N1 ALBB-006866 [1,0,0,0,0,0|2,1,0]=4 9 B12R2.606 CC1=CC=C2NC(=O)NC2=C1 ALBB-015046 [1,0,0,0,0,0|1,0,0]=2 10 B12R2.606 CC1=CC=C2NC(=O)OC2=C1 ALBB-013599 [1,0,0,0,0,0|2,0,0]=3 11 B12R2.606 CC1=CC=C2NC(C)=CC2=C1 ALBB-007737 [1,0,0,0,0,0|3,0,0]=4 12 B12R2.606 CC1=CC=C2NC(C)=NC2=C1 ALBB-028792 [1,0,0,0,0,0|2,0,1]=4 13 B12R2.606 CC1=CC=C2OC(=O)NC2=C1 ALBB-013600 [1,0,0,0,0,0|2,0,0]=3 14 B12R2.606 CC1=NC2=CC(Cl)=CC=C2N1 ALBB-028793 [1,0,0,0,0,0|1,1,1]=4 15 B12R2.606 CC1=NC2=CC(N)=CC=C2N1 ALBB-005602 [1,0,0,0,0,0|2,0,1]=4 16 B12R2.606 CC1=NC2=CC(N)=CC=C2N1 ALBB-005602 [1,0,0,0,0,0|2,0,1]=4 17 B12R2.606 FC1=CC=C2N=C(S)NC2=C1 ALBB-004035 [1,0,0,0,0,0|0,1,1]=3 18 B12R2.606 FC1=CC=C2N=C(S)OC2=C1 ALBB-036260 [1,0,0,0,0,0|1,1,1]=4 19 B12R2.606 FC1=CC=C2OC(S)=NC2=C1 ALBB-036256 [1,0,0,0,0,0|1,1,1]=4 20 B12R2.606 NC1=CC2=C(C=C1)NC(=O)C2 ALBB-022013 [1,0,0,0,0,0|2,0,0]=3 21 B12R2.606 NC1=CC2=C(C=C1)OC(=O)N2 ALBB-024994 [1,0,0,0,0,0|2,0,0]=3 22 B12R2.606 NC1=CC2=C(C=C1)OC(=O)N2 ALBB-024994 [1,0,0,0,0,0|2,0,0]=3 23 B12R2.606 NC1=CC=C2NC(=O)NC2=C1 ALBB-023220 [1,0,0,0,0,0|1,0,0]=2 24 B12R2.606 O=C1CC2=C(C=C(Cl)C=C2)N1 ALBB-021329 [1,0,0,0,0,0|1,1,0]=3 25 B12R2.606 O=C1CC2=C(C=CC(Cl)=C2)N1 ALBB-006976 [1,0,0,0,0,0|1,1,0]=3 26 B12R2.606 O=C1CC2=CC(O)=CC=C2O1 ALBB-023609 [1,0,0,0,0,0|3,0,0]=4 27 B12R2.606 O=C1NC2=C(C=C(Br)C=C2)S1 ALBB-012653 [1,0,0,0,0,0|1,1,0]=3 28 B12R2.606 O=C1NC2=C(C=C(Cl)C=C2)O1 ALBB-012646 [1,0,0,0,0,0|1,1,0]=3 29 B12R2.606 O=C1NC2=C(C=CC(Cl)=C2)O1 ALBB-012641 [1,0,0,0,0,0|1,1,0]=3 30 B12R2.606 O=C1NC2=CC=C(Br)C=C2N1 ALBB-026683 [1,0,0,0,0,0|0,1,0]=2 31 B12R2.606 OC1=NC2=CC=C(F)C=C2N1 ALBB-030906 [1,0,0,0,0,0|0,0,2]=3 32 B12R2.606 SC1=NC2=CC=C(Cl)C=C2N1 ALBB-004034 [1,0,0,0,0,0|0,2,1]=4 33 B14R2.1060 CC1=C(C=O)NC2=CC=C(Cl)C=C21 ALBB-013295 [0,1,0,0,0,0|2,1,0]=4 34 B14R2.3274 CCC1=CC2=C(C=C1)NC(=O)C2=O ALBB-002984 [0,1,0,0,0,0|2,0,1]=4 35 B14R2.3274 COC1=CC2=C(C=C1)NC(=O)C2=O ALBB-002983 [0,1,0,0,0,0|2,0,1]=4 36 B14R2.8716 CN1C(=O)C(=O)C2=CC(Br)=CC=C21 ALBB-023282 [0,1,0,0,0,0|1,1,1]=4 37 B14R2.8716 CN1C(=O)C(=O)C2=CC(F)=CC=C21 ALBB-012258 [0,1,0,0,0,0|1,0,1]=3 38 B14R2.9184 CC1=C2NC(=O)C(=O)C2=CC(Br)=C1 ALBB-010538 [0,1,0,0,0,0|1,1,1]=4 39 B14R2.9184 CC1=CC2=C(NC(=O)C2=O)C(C)=C1 ALBB-002978 [0,1,0,0,0,0|2,0,1]=4 40 B14R2.9184 O=C1NC2=C(C=C(Br)C=C2Br)C1=O ALBB-014968 [0,1,0,0,0,0|1,1,1]=4 41 B14R2.19008 O=C1NC2=CC=C(Cl)C=C2\C1=N\O ALBB-014431 [0,1,0,0,0,0|1,1,0]=3 42 B12R1.49 CC1=CC=C(CC(=O)NN)C=C1 ALBB-007085 [0,0,1,0,0,0|3,0,0]=4 43 B12R1.49 CC1=CC=C(NC(=O)CBr)C=C1 ALBB-010530 [0,0,1,0,0,0|3,0,0]=4 44 B12R1.49 CC1=CC=C(NC(=O)CCl)C=C1 ALBB-002258 [0,0,1,0,0,0|3,0,0]=4 45 B12R1.49 CC1=CC=C(NC(=O)CS)C=C1 ALBB-017013 [0,0,1,0,0,0|2,1,0]=4 46 B12R1.49 CC1=CC=C(NC(=S)NN)C=C1 ALBB-002829 [0,0,1,0,0,0|2,1,0]=4 47 B12R1.49 CNC(=O)CC1=CC=C(Br)C=C1 ALBB-022754 [0,0,1,0,0,0|2,1,0]=4 48 B12R1.49 NNC(=O)CC1=CC=C(Br)C=C1 ALBB-001041 [0,0,1,0,0,0|2,1,0]=4 49 B12R1.49 NNC(=O)CC1=CC=C(Cl)C=C1 ALBB-001040 [0,0,1,0,0,0|2,1,0]=4 50 B12R1.49 NNC(=O)CC1=CC=C(F)C=C1 ALBB-020997 [0,0,1,0,0,0|2,0,0]=3 51 B12R1.49 NNC(=O)CC1=CC=C(O)C=C1 ALBB-002667 [0,0,1,0,0,0|3,0,0]=4 52 B12R1.49 NNC(=S)NC1=CC=C(Cl)C=C1 ALBB-002828 [0,0,1,0,0,0|1,2,0]=4 53 B12R1.49 O=C(CBr)NC1=CC=C(Br)C=C1 ALBB-010614 [0,0,1,0,0,0|2,1,0]=4 54 B12R1.49 O=C(CBr)NC1=CC=C(Cl)C=C1 ALBB-010554 [0,0,1,0,0,0|2,1,0]=4 55 B12R1.49 O=C(CCl)NC1=CC=C(Br)C=C1 ALBB-002249 [0,0,1,0,0,0|2,1,0]=4 56 B12R1.49 O=C(CCl)NC1=CC=C(Cl)C=C1 ALBB-002248 [0,0,1,0,0,0|2,1,0]=4 57 B12R1.49 O=C(CCl)NC1=CC=C(F)C=C1 ALBB-002247 [0,0,1,0,0,0|2,0,0]=3 58 B12R1.49 O=C(CCl)NC1=CC=C(I)C=C1 ALBB-019129 [0,0,1,0,0,0|2,1,0]=4 59 B12R1.49 O=C(CS)NC1=CC=C(F)C=C1 ALBB-017011 [0,0,1,0,0,0|1,1,0]=3 60 B14R2.8235 CC1=CC(=O)NC2=CC=C(Br)C=C12 ALBB-025305 [0,0,0,0,0,1|2,1,0]=4 61 B14R2.8235 CC1=CC(=O)NC2=CC=C(F)C=C12 ALBB-024320 [0,0,0,0,0,1|2,0,0]=3 62 B14R2.8235 CC1=CC=C2NC(=O)C=C(C)C2=C1 ALBB-024297 [0,0,0,0,0,1|3,0,0]=4 63 B14R2.8235 CC1=CC=C2OC(=O)C=C(O)C2=C1 ALBB-007066 [0,0,0,0,0,1|3,0,0]=4 64 B14R2.8239 CC1=CC=C2NC(=O)C(=O)NC2=C1 ALBB-024742 [0,0,0,0,0,1|2,0,1]=4 65 B11R1.40 NCC(=O)NC1=CC=CC=C1 ALBB-032235 [1,0,1,0,0,0|2,0,0]=4 66 B11R1.40 NNC(=O)CC1=CC=CC=C1 ALBB-001037 [1,0,1,0,0,0|2,0,0]=4 67 B11R1.40 NNC(=O)NC1=CC=CC=C1 ALBB-002786 [1,0,1,0,0,0|1,0,0]=3 68 B11R1.40 NNC(=O)NC1=CC=CC=C1 ALBB-002786 [1,0,1,0,0,0|1,0,0]=3 69 B11R1.40 NNC(=S)NC1=CC=CC=C1 ALBB-002787 [1,0,1,0,0,0|1,1,0]=4 70 B11R1.40 O=C(CCl)NC1=CC=CC=C1 ALBB-002246 [1,0,1,0,0,0|2,0,0]=4 71 B11R1.40 O=C(CS)NC1=CC=CC=C1 ALBB-017010 [1,0,1,0,0,0|1,1,0]=4 72 B11R1.36 NC(=O)C(Cl)C1=CC=CC=C1 ALBB-019794 [1,0,1,0,0,0|2,0,0]=4 73 B11R1.157 CC(=O)NC1=CC=CC(N)=C1 ALBB-025724 [1,0,1,0,0,0|2,0,0]=4 74 B11R1.157 NC(=O)NC1=CC(O)=CC=C1 ALBB-035798 [1,0,1,0,0,0|1,0,0]=3 75 B11R1.157 NC(=S)NC1=CC=CC(Br)=C1 ALBB-034435 [1,0,1,0,0,0|0,2,0]=4 76 B11R1.167 CC1=CC(C(=O)O)=C(N)C=C1 ALBB-006381 [1,0,1,0,0,0|2,0,0]=4 77 B11R1.167 NC1=C(C(=O)O)C=C(F)C=C1 ALBB-006133 [1,0,1,0,0,0|1,0,0]=3 78 B11R2.1 ON1N=NC2=CC=CC=C21 ALBB-013485 [2,0,0,0,0,0|1,0,1]=4 79 B11R2.36 CC1=CC2=C(C=C1)NC=C2 ALBB-033002 [2,0,0,0,0,0|2,0,0]=4 80 B11R2.36 CC1=CC2=C(C=CN2)C=C1 ALBB-005930 [2,0,0,0,0,0|2,0,0]=4 81 B11R2.36 CC1=CC=C2NC=NC2=C1 ALBB-028791 [2,0,0,0,0,0|1,0,1]=4 82 B11R2.36 ClC1=CC2=C(C=C1)NC=C2 ALBB-006063 [2,0,0,0,0,0|1,1,0]=4 83 B11R2.36 ClC1=CC2=C(C=CN2)C=C1 ALBB-006051 [2,0,0,0,0,0|1,1,0]=4 84 B11R2.36 NC1=CC=C2NC=NC2=C1 ALBB-023267 [2,0,0,0,0,0|1,0,1]=4 85 B13R1.19 CNCC(=O)NC1=CC=C(C)C=C1 ALBB-007075 [0,1,1,0,0,0|2,0,0]=4 86 B13R1.19 CNCC(=O)NC1=CC=C(F)C=C1 ALBB-006969 [0,1,1,0,0,0|1,0,0]=3 87 B13R1.19 N#CCC(=O)NC1=CC=C(F)C=C1 ALBB-008600 [0,1,1,0,0,0|2,0,0]=4 88 B13R1.19 O=C(CCCl)NC1=CC=C(F)C=C1 ALBB-018983 [0,1,1,0,0,0|2,0,0]=4 89 B13R1.133 CC(Br)C(=O)NC1=CC=C(F)C=C1 ALBB-007251 [0,1,1,0,0,0|2,0,0]=4 90 B13R1.133 CC(Cl)C(=O)NC1=CC=C(F)C=C1 ALBB-018816 [0,1,1,0,0,0|2,0,0]=4 91 B13R1.133 CC1=CC=C(NC(=O)C(=O)O)C=C1 ALBB-009514 [0,1,1,0,0,0|2,0,0]=4 92 B13R1.133 O=C(O)C(=O)NC1=CC=C(F)C=C1 ALBB-009509 [0,1,1,0,0,0|1,0,0]=3 93 B13R1.2679 CC1=C(NC(=O)CCl)C=CC(F)=C1 ALBB-002391 [0,1,1,0,0,0|2,0,0]=4 94 B13R1.2679 CC1=CC(F)=CC=C1NC(=O)CBr ALBB-030974 [0,1,1,0,0,0|2,0,0]=4 95 B13R1.2679 NNC(=S)NC1=C(F)C=C(F)C=C1 ALBB-002827 [0,1,1,0,0,0|1,1,0]=4 96 B13R1.2679 O=C(CBr)NC1=CC=C(F)C=C1Cl ALBB-030971 [0,1,1,0,0,0|2,0,0]=4 97 B13R1.2679 O=C(CBr)NC1=CC=C(F)C=C1F ALBB-030931 [0,1,1,0,0,0|2,0,0]=4 98 B13R1.2679 O=C(CCl)NC1=CC=C(F)C=C1F ALBB-002316 [0,1,1,0,0,0|2,0,0]=4 99 B13R1.2879 CC1=C(F)C=CC(NC(=O)CBr)=C1 ALBB-030984 [0,1,1,0,0,0|2,0,0]=4 100 B13R1.2879 O=C(CBr)NC1=CC(Cl)=C(F)C=C1 ALBB-030982 [0,1,1,0,0,0|2,0,0]=4 101 B13R1.2879 O=C(CBr)NC1=CC(F)=C(F)C=C1 ALBB-030978 [0,1,1,0,0,0|2,0,0]=4 102 B13R1.2879 O=C(CCl)NC1=CC(F)=C(F)C=C1 ALBB-002464 [0,1,1,0,0,0|2,0,0]=4 103 B13R1.2879 O=C(CCl)NC1=CC=C(F)C(Cl)=C1 ALBB-002321 [0,1,1,0,0,0|2,0,0]=4 104 B13R2.45 CN1C(C=O)=CC2=CC=CC=C21 ALBB-014513 [1,1,0,0,0,0|2,0,0]=4 105 B13R2.45 CN1C2=CC=CC=C2N=C1C=O ALBB-017594 [1,1,0,0,0,0|1,0,1]=4 106 B13R2.135 CCN1C(=O)NC2=CC=CC=C21 ALBB-016286 [1,1,0,0,0,0|1,0,0]=3 107 B13R2.135 N\N=C1/C(=O)NC2=CC=CC=C21 ALBB-032084 [1,1,0,0,0,0|2,0,0]=4 108 B13R2.135 O=C1NC2=C(C=CC=C2)\C1=N/O ALBB-006595 [1,1,0,0,0,0|1,0,0]=3 109 B13R2.135 O=CC1C(=O)NC2=CC=CC=C21 ALBB-011784 [1,1,0,0,0,0|1,0,1]=4 110 B13R2.359 CC1(C)C(=O)NC2=CC=CC=C21 ALBB-018374 [1,1,0,0,0,0|2,0,0]=4 111 B13R2.359 O=C1NC2=CC=CC=C2C1(Cl)Cl ALBB-016907 [1,1,0,0,0,0|2,0,0]=4 112 B13R2.3085 CN1C(=O)C(=O)C2=C1C=CC=C2 ALBB-016867 [1,1,0,0,0,0|1,0,1]=4 113 B13R2.3085 CN1C(=O)C(N)C2=CC=CC=C21 ALBB-014689 [1,1,0,0,0,0|2,0,0]=4 114 B13R2.3085 CN1C(=O)N(C)C2=CC=CC=C21 ALBB-012783 [1,1,0,0,0,0|1,0,0]=3 115 B13R2.4825 CC1=CC=CC2=C1NC(=O)C2=O ALBB-002977 [1,1,0,0,0,0|1,0,1]=4 116 B13R2.4825 O=C1NC2=C(C=CC=C2Cl)C1=O ALBB-002976 [1,1,0,0,0,0|1,0,1]=4 117 B13R2.4856 O=C1NC2=C(C1=O)C(Br)=CC=C2 ALBB-002982 [1,1,0,0,0,0|1,0,1]=4 118 B13R2.5190 CC1=CC=C2C(=O)C(=O)NC2=C1 ALBB-014228 [1,1,0,0,0,0|1,0,1]=4 119 B13R2.5190 CN1C(=O)CC2=CC(Br)=CC=C21 ALBB-008752 [1,1,0,0,0,0|2,0,0]=4 120 B13R2.5190 CN1C(=O)OC2=CC(N)=CC=C21 ALBB-026258 [1,1,0,0,0,0|2,0,0]=4 121 B13R2.5190 O=C1NC2=C(C=CC(Br)=C2)C1=O ALBB-002981 [1,1,0,0,0,0|1,0,1]=4 122 B13R2.43 OCC1=NC2=CC(F)=CC=C2N1 ALBB-018707 [1,1,0,0,0,0|0,0,2]=4 123 B13R2.2121 CCC1=CC=C2NC(=O)CC2=C1 ALBB-030908 [1,1,0,0,0,0|2,0,0]=4 124 B13R2.5397 CC1=CC2=C(NC(=S)N2)C(C)=C1 ALBB-023723 [1,1,0,0,0,0|1,1,0]=4 125 B15R2.59733 O=C1NC2=C(C=C(F)C(F)=C2)C(=O)O1 ALBB-034526 [0,1,0,0,0,1|1,0,1]=4 126 B15R2.7203 CC1=C(C(=O)O)NC2=CC=C(F)C=C21 ALBB-005029 [0,2,0,0,0,0|2,0,0]=4 127 B15R2.4800 CCC1=CC=C2NC(=O)\C(=N\O)C2=C1 ALBB-015029 [0,2,0,0,0,0|2,0,0]=4 128 B15R2.22335 CN1C(=O)N(C)C2=CC(CN)=CC=C21 ALBB-010226 [0,2,0,0,0,0|2,0,0]=4 129 B15R2.22335 CN1C(=O)N(C)C2=CC(CN)=CC=C21 ALBB-010226 [0,2,0,0,0,0|2,0,0]=4 130 B15R2.7204 CC1=C(C(=O)O)C2=CC(F)=CC=C2N1 ALBB-035481 [0,2,0,0,0,0|2,0,0]=4 131 B13R2.3683 CC1=CC=C2NC(=O)COC2=C1 ALBB-023916 [0,0,1,1,0,0|2,0,0]=4 132 B13R2.3683 O=C1CCC2=CC(F)=CC=C2N1 ALBB-024711 [0,0,1,1,0,0|2,0,0]=4 133 B11R1.22 CNC(=O)C1=CC=C(Br)C=C1 ALBB-012016 [0,0,1,0,1,0|1,1,0]=4 134 B11R1.22 CNC(=O)C1=CC=C(N)C=C1 ALBB-002184 [0,0,1,0,1,0|2,0,0]=4 135 B11R1.22 NNC(=O)C1=CC=C(O)C=C1 ALBB-001058 [0,0,1,0,1,0|2,0,0]=4 136 B11R1.22 N\C(=N/O)C1=CC=C(F)C=C1 ALBB-014811 [0,0,1,0,1,0|1,0,1]=4 137 B11R1.22 O=C(CO)C1=CC=C(F)C=C1 ALBB-036263 [0,0,1,0,1,0|1,0,0]=3 138 B13R1.14 NNC(=O)CNC1=CC=C(Cl)C=C1 ALBB-003960 [0,0,1,0,0,1|1,1,0]=4 139 B13R1.14 NNC(=O)CNC1=CC=C(I)C=C1 ALBB-003963 [0,0,1,0,0,1|1,1,0]=4 140 B13R1.14 NNC(=O)COC1=CC=C(F)C=C1 ALBB-002574 [0,0,1,0,0,1|2,0,0]=4 141 B13R1.14 O=C(CCl)NCC1=CC=C(F)C=C1 ALBB-002452 [0,0,1,0,0,1|2,0,0]=4 142 B13R1.14 O=C(\C=C\C1=CC=C(Cl)C=C1)NO ALBB-033510 [0,0,1,0,0,1|1,1,0]=4 143 B13R2.32 CN1C(=O)C=CC2=CC=CC=C21 ALBB-032305 [1,0,0,0,0,1|2,0,0]=4 144 B13R2.328 O=C1C=C(O)C2=C(C=CC=C2)N1 ALBB-006386 [1,0,0,0,0,1|1,0,0]=3 145 B13R2.369 CC1=NC2=CC=CC=C2NC1=O ALBB-020076 [1,0,0,0,0,1|2,0,0]=4 146 B13R2.369 CC1NC2=CC=CC=C2NC1=O ALBB-031489 [1,0,0,0,0,1|2,0,0]=4 147 B13R2.369 CC1OC2=CC=CC=C2NC1=O ALBB-024345 [1,0,0,0,0,1|2,0,0]=4 148 B13R2.369 O=C1NC2=CC=CC=C2OC1=O ALBB-016477 [1,0,0,0,0,1|1,0,1]=4