0 B9R1.6 CC(=O)C1=CC=CN=N1 4H56-1-030 [0,0,0,0,0,0|2,0,0]=2 1 B9R1.6 CC(N)C1=CC=NN=C1 3H30-1-DF [0,0,0,0,0,0|3,0,1]=4 2 B9R1.6 CN(N)C1=NC=CN=C1 3H39-1-0B [0,0,0,0,0,0|2,0,0]=2 3 B9R1.6 O=C(Cl)C1=CC=NC=N1 4H16-4-01 [0,0,0,0,0,0|3,0,0]=3 4 B8R1.2 CNC1=CC=NC=N1 3H32-1-LX [1,0,0,0,0,0|3,0,0]=4 5 B8R1.2 ICC1=CC=CN=C1 3H32-H-90 [1,0,0,0,0,0|2,0,1]=4 6 B8R1.2 SCC1=CC=CN=C1 7H61-1-08 [1,0,0,0,0,0|1,1,1]=4 7 B10R1.13 CC(=O)C1=CC=C(Cl)N=N1 4H17-5-2C [0,1,0,0,0,0|2,0,0]=3 8 B10R1.13 CC(C)C1=CC=C(N)N=C1 3H30-1-3E [0,1,0,0,0,0|2,0,1]=4 9 B10R1.13 CC1=CC=C(C(C)O)C=N1 4H02-1-0E [0,1,0,0,0,0|1,0,2]=4 10 B10R1.13 CC1=CN=C(C(F)F)C=N1 3H32-3-8Y [0,1,0,0,0,0|2,0,1]=4 11 B10R1.13 CN(C)C1=CC=C(F)C=N1 3H32-3-6P [0,1,0,0,0,0|3,0,0]=4 12 B10R1.13 CS(=O)C1=CC=C(Cl)C=C1 6665-5-03 [0,1,0,0,0,0|3,0,0]=4 13 B10R1.13 C[C@H](N)C1=CC=C(Cl)N=C1 3H30-5-S6 [0,1,0,0,0,0|2,0,1]=4 14 B10R1.13 NC(=O)C1=CN=C(F)C=C1 4H48-3-8L [0,1,0,0,0,0|2,0,0]=3 15 B10R1.13 NC1=CC=C(C(=O)Cl)C=C1 4630-5-0B [0,1,0,0,0,0|3,0,0]=4 16 B10R1.13 O=C(Cl)C1=CC=C(F)C=N1 4H16-7-0B [0,1,0,0,0,0|2,0,0]=3 17 B10R1.13 O=C(O)C1=NC=C(F)C=N1 4H58-3-1K [0,1,0,0,0,0|3,0,0]=4 18 B10R1.13 O=C1C=CC(C(=O)Cl)=CO1 2H16-5-08 [0,1,0,0,0,0|3,0,0]=4 19 B10R1.13 O=[N+]([O-])C1=NC=C(Cl)N=C1 4H54-5-16 [0,1,0,0,0,0|2,0,0]=3 20 B10R1.15 C=C(CBr)C1=CC=CC=C1 1900-9-0J [0,1,0,0,0,0|3,0,0]=4 21 B10R1.15 C=CC(=O)C1=CC=CC=C1 2617-1-0U [0,1,0,0,0,0|2,0,1]=4 22 B10R1.15 C[C@@H](C=O)C1=CC=CC=C1 2615-1-R0 [0,1,0,0,0,0|2,0,1]=4 23 B10R1.15 C[C@H](C=O)C1=CC=CC=C1 2615-1-S0 [0,1,0,0,0,0|2,0,1]=4 24 B10R1.15 C\C(=N\O)C1=NC=CN=C1 4H50-1-Z0 [0,1,0,0,0,0|0,0,1]=2 25 B10R1.15 NCC(O)C1=CC=CC=N1 4H30-1-6H [0,1,0,0,0,0|1,0,2]=4 26 B10R1.15 O=C(CCl)C1=CC=NC=C1 4H33-5-0L [0,1,0,0,0,0|3,0,0]=4 27 B10R1.61 CC(=O)C1=NC=CN=C1N 4H56-1-0B [0,1,0,0,0,0|0,0,0]=1 28 B10R1.61 CC(C)C1=CC=CN=C1N 3H30-1-LE [0,1,0,0,0,0|2,0,1]=4 29 B10R1.61 CC1=CC=NC=C1C(N)=O 4H48-1-7Q [0,1,0,0,0,0|2,0,0]=3 30 B10R1.61 CS(=O)C1=CC=CC=C1I 6667-H-00 [0,1,0,0,0,0|3,0,0]=4 31 B10R1.61 O=C(Cl)C1=C(Cl)C=CC=N1 4H16-5-0K [0,1,0,0,0,0|2,0,0]=3 32 B10R1.61 O=C(Cl)C1=C(F)C=CC=N1 4H16-7-0F [0,1,0,0,0,0|2,0,0]=3 33 B10R1.61 O=C(Cl)C1=CC=CC=C1O 2616-5-0D [0,1,0,0,0,0|3,0,0]=4 34 B10R1.61 O=C(Cl)C1=CC=CC=C1S 6661-5-00 [0,1,0,0,0,0|3,0,0]=4 35 B10R1.61 O=C(O)C1=CC=CC=C1S 6661-1-X8 [0,1,0,0,0,0|3,0,0]=4 36 B10R1.113 CN(C)C1=CC(Cl)=CC=N1 3H32-5-ND [0,1,0,0,0,0|3,0,0]=4 37 B10R1.113 CN(C)C1=CC=CC(Cl)=N1 3H32-5-TA [0,1,0,0,0,0|3,0,0]=4 38 B10R1.113 CS(=O)C1=CC(Cl)=CC=C1 6665-5-04 [0,1,0,0,0,0|3,0,0]=4 39 B10R1.113 CS(=O)C1=CC(O)=CC=C1 6665-1-0E [0,1,0,0,0,0|3,0,0]=4 40 B10R1.113 NC1=CC(C(=O)O)=NC=N1 4H57-1-64 [0,1,0,0,0,0|3,0,0]=4 41 B10R1.113 NC1=CC=NC([N+](=O)[O-])=C1 4H55-1-55 [0,1,0,0,0,0|3,0,0]=4 42 B10R1.113 O=C(Cl)C1=CC=CC(Br)=N1 4H16-D-02 [0,1,0,0,0,0|2,0,0]=3 43 B10R1.113 O=C(Cl)C1=CN=CC(F)=C1 4H16-7-0E [0,1,0,0,0,0|2,0,0]=3 44 B10R1.113 O=[N+]([O-])C1=CN=CC(Cl)=C1 4H54-5-5E [0,1,0,0,0,0|3,0,0]=4 45 B8R1.7 CC(=O)C1=CNN=C1 4H17-1-3L [0,0,0,0,1,0|1,0,0]=2 46 B8R1.7 CC(=O)C1=NC=CN1 4H17-1-3M [0,0,0,0,1,0|0,0,1]=2 47 B8R1.7 CC(C)N1C=CC=N1 3H32-1-CY [0,0,0,0,1,0|2,0,1]=4 48 B8R1.7 CC(N)C1=CC=CO1 4H56-1-1T [0,0,0,0,1,0|2,0,1]=4 49 B8R1.7 CC(N)C1=CN=CO1 4H30-1-39 [0,0,0,0,1,0|2,0,1]=4 50 B8R1.7 CC(N)C1=COC=C1 4H30-1-CY [0,0,0,0,1,0|2,0,1]=4 51 B8R1.7 NC(=O)C1=CC=NO1 4H48-1-H4 [0,0,0,0,1,0|2,0,0]=3 52 B10R1.18 O=C([O-])CC1=CC=NN=C1 4H58-1-QC [0,0,0,0,0,1|3,0,0]=4 53 B10R1.18 O=C([O-])CC1=NC=CC=N1 4H58-1-QD [0,0,0,0,0,1|3,0,0]=4 54 B7R0.4 C\C=C\C=C\C(C)=O 2317-1-0E [1,0,1,0,0,0|1,0,0]=3 55 B9R1.1 CCC1=CC=C(Br)N=C1 3H32-9-5W [1,1,0,0,0,0|1,0,1]=4 56 B9R1.1 CNC1=CC=C(Br)N=C1 3H31-9-0Z [1,1,0,0,0,0|2,0,0]=4 57 B9R1.1 CNC1=CC=C(F)C=N1 3H32-3-6Y [1,1,0,0,0,0|2,0,0]=4 58 B9R1.1 CNC1=CC=C(F)C=N1 3H32-7-5E [1,1,0,0,0,0|2,0,0]=4 59 B9R1.1 COC1=CN=C(O)C=C1 4H07-1-6A [1,1,0,0,0,0|2,0,0]=4 60 B9R1.1 CSC1=CC=C(O)C=N1 8H66-1-AP [1,1,0,0,0,0|2,0,0]=4 61 B9R1.1 O=CC1=NC=C(F)C=N1 4H15-3-37 [1,1,0,0,0,0|2,0,0]=4 62 B9R1.2 CNC1=CC(Br)=CC=N1 3H31-9-18 [1,1,0,0,0,0|2,0,0]=4 63 B9R1.2 CNC1=CC(Cl)=CC=N1 3H31-5-5V [1,1,0,0,0,0|2,0,0]=4 64 B9R1.2 CNC1=CN=CC(Br)=C1 2H31-9-00 [1,1,0,0,0,0|2,0,0]=4 65 B9R1.2 COC1=CC=CC(O)=N1 4H07-1-4R [1,1,0,0,0,0|2,0,0]=4 66 B9R1.2 COC1=CN=CC(F)=C1 4H06-3-00 [1,1,0,0,0,0|2,0,0]=4 67 B9R1.2 CSC1=CN=CC(O)=C1 8H66-1-AQ [1,1,0,0,0,0|2,0,0]=4 68 B9R1.2 CSC1=NC(Cl)=CC=C1 8H66-5-4P [1,1,0,0,0,0|2,0,0]=4 69 B9R1.8 NNCC1=CN=CC=N1 3H39-1-34 [1,1,0,0,0,0|1,0,1]=4 70 B9R1.8 O=C=NC1=CC=CN=C1 4H49-1-02 [1,1,0,0,0,0|1,0,1]=4 71 B9R1.15 C=CC1=CC=CN=C1F 3H32-3-C4 [1,1,0,0,0,0|1,0,1]=4 72 B9R1.15 CNC1=C(Cl)N=CC=C1 3H31-5-AG [1,1,0,0,0,0|2,0,0]=4 73 B9R1.15 NC1=NC=CN=C1CO 4H56-1-456 [1,1,0,0,0,0|0,0,2]=4 74 B9R1.11 COC(=O)C1=COC=N1 4H23-1-CN [0,1,0,0,1,0|1,0,0]=3 75 B9R1.11 COC(=O)C1=NOC=C1 4H23-1-J4 [0,1,0,0,1,0|1,0,0]=3 76 B9R1.35 CC(=O)C1=CC(C)=NS1 8H15-1-0F [0,1,0,0,1,0|1,0,0]=3 77 B9R1.35 CC(=O)C1=CC=C(Br)O1 2H17-9-30 [0,1,0,0,1,0|1,0,0]=3 78 B9R1.35 CC(=O)C1=NC=C(Br)S1 8H70-9-16 [0,1,0,0,1,0|1,0,0]=3 79 B9R1.35 CC(=O)N1C=CC(N)=C1 4H48-1-WC [0,1,0,0,1,0|2,0,0]=4 80 B9R1.35 CC1=NC(C(=O)Cl)=CO1 4H56-5-H1 [0,1,0,0,1,0|2,0,0]=4 81 B9R1.35 NC1=NC(C(=O)O)=CN1 4H57-1-0E [0,1,0,0,1,0|1,0,1]=4 82 B9R1.35 O=C(O)C1=CC(I)=CN1 4H21-H-0D [0,1,0,0,1,0|1,0,1]=4 83 B9R1.41 CC(=O)C1=NON=C1C 4H17-1-6E [0,1,0,0,1,0|1,0,0]=3 84 B9R1.41 CC1=C(C(=O)Cl)C=CS1 6H16-5-0A [0,1,0,0,1,0|2,0,0]=4 85 B9R1.41 CC1=C(C(=O)Cl)N=CO1 4H16-5-X7 [0,1,0,0,1,0|2,0,0]=4 86 B9R1.41 CC1=C(C(=O)O)SN=C1 8H70-1-88 [0,1,0,0,1,0|2,0,0]=4 87 B9R1.41 CC1=CNC=C1C(=O)O 4H21-1-63 [0,1,0,0,1,0|1,0,1]=4 88 B9R1.41 O=C(O)C1=C(Br)C=CO1 2H21-9-0K [0,1,0,0,1,0|2,0,0]=4 89 B11R1.20 CC(=O)NC1=CC=C(Cl)N=C1 4H48-5-HJ [0,1,0,0,0,1|1,0,0]=3 90 B11R1.20 NC1=CC=C(CC(=O)O)C=N1 4H57-1-02 [0,1,0,0,0,1|2,0,0]=4 91 B11R1.36 NC(C(=O)O)C1=CC=CC=N1 4H57-5-24 [0,1,0,0,0,1|2,0,0]=4 92 B11R1.40 CNC(=O)OC1=CC=CC=C1 4656-1-7R [0,1,0,0,0,1|2,0,0]=4 93 B11R1.40 COC(=O)CC1=CC=NN=C1 4H58-1-AW [0,1,0,0,0,1|2,0,0]=4 94 B11R1.86 CC(=O)NC1=NC=CC=C1N 4H48-1-97 [0,1,0,0,0,1|1,0,0]=3 95 B11R1.86 CC(=O)NC1=NN=CC=C1C 4H48-1-WE [0,1,0,0,0,1|2,0,0]=4 96 B11R1.157 CC(=O)NC1=CC(C)=CN=N1 4H48-1-WF [0,1,0,0,0,1|2,0,0]=4 97 B11R1.157 CC(=O)NC1=CC(N)=NC=N1 4H48-1-B1 [0,1,0,0,0,1|2,0,0]=4 98 B11R1.157 O=C(O)CC1=CN=CC(F)=C1 4H58-3-1L [0,1,0,0,0,1|2,0,0]=4 99 B11R1.3 CC(=O)C1=CC=C(CO)C=C1 2620-1-57 [0,2,0,0,0,0|2,0,0]=4 100 B11R1.3 O=C(O)C1=CC=C(CBr)N=C1 4H58-9-97 [0,2,0,0,0,0|2,0,0]=4 101 B11R1.21 CC(=O)C1=CC(O)=C(Cl)C=C1 2617-5-1G [0,2,0,0,0,0|2,0,0]=4 102 B11R1.21 CC(=O)C1=CC=C(C)C(N)=C1 4756-1-1S [0,2,0,0,0,0|2,0,0]=4 103 B11R1.21 CC(=O)C1=CC=C(N)C(Cl)=C1 4656-5-2D [0,2,0,0,0,0|2,0,0]=4 104 B11R1.21 CC(=O)C1=CC=C(N)C(I)=C1 4656-H-0A [0,2,0,0,0,0|2,0,0]=4 105 B11R1.21 CC1=CC(C(N)=O)=NC=C1Br 4H48-9-0S [0,2,0,0,0,0|2,0,0]=4 106 B11R1.21 NC1=CC(C(=O)O)=CN=C1N 4H57-1-15 [0,2,0,0,0,0|2,0,0]=4 107 B11R1.21 NC1=NC=C(C(=O)O)N=C1Br 4H57-1-72 [0,2,0,0,0,0|1,0,0]=3 108 B11R1.21 O=C(Cl)C1=CN=C(Cl)C(Br)=C1 4H16-D-00 [0,2,0,0,0,0|2,0,0]=4 109 B11R1.21 O=C(O)C1=CN=C(O)C(O)=C1 4H58-1-499 [0,2,0,0,0,0|2,0,0]=4 110 B11R1.22 CC1=CC=C(C(=O)CN)C=C1 4756-5-16 [0,2,0,0,0,0|2,0,0]=4 111 B11R1.22 CNC(=O)C1=CC=C(Cl)C=C1 4648-5-0U [0,2,0,0,0,0|2,0,0]=4 112 B11R1.22 COC(=O)C1=NC=C(N)C=N1 4H58-1-VS [0,2,0,0,0,0|2,0,0]=4 113 B11R1.22 O=C(CCl)C1=CC=C(F)C=N1 4H17-7-0M [0,2,0,0,0,0|1,0,0]=3 114 B11R1.166 CC(=O)C1=C(C)N=C(O)C=C1 4H17-1-4Y [0,2,0,0,0,0|1,0,0]=3 115 B11R1.166 CC(=O)C1=CN=C(Cl)C=C1Cl 4656-5-56 [0,2,0,0,0,0|1,0,0]=3 116 B11R1.166 CC(=O)C1=CN=C(Cl)N=C1Cl 4H56-5-F2 [0,2,0,0,0,0|2,0,0]=4 117 B11R1.166 CC1=CC=C(C(=O)Cl)C(C)=N1 4H16-5-65 [0,2,0,0,0,0|2,0,0]=4 118 B11R1.166 CC1=CN=C(C(=O)O)C(F)=C1 4H21-3-71 [0,2,0,0,0,0|2,0,0]=4 119 B11R1.166 CC1=NC(N)=CC=C1C(=O)O 4H57-1-51 [0,2,0,0,0,0|2,0,0]=4 120 B11R1.166 NC(=O)C1=CC=C(Cl)N=C1N 4H48-5-DF [0,2,0,0,0,0|2,0,0]=4 121 B11R1.166 O=C(Cl)C1=NC=C(Cl)C=C1Cl 4H16-5-0H [0,2,0,0,0,0|2,0,0]=4 122 B11R1.7 CC(C)(CN)C1=CN=CC=N1 3H30-1-9P [0,2,0,0,0,0|1,0,1]=4 123 B11R1.16 CC(NC=O)C1=CN=CC=C1 4H48-1-3J [0,2,0,0,0,0|1,0,1]=4 124 B11R1.16 CC(NC=O)C1=NC=CC=C1 4H48-1-3H [0,2,0,0,0,0|1,0,1]=4 125 B11R1.23 CNC(=O)C1=CC(Cl)=CC=C1 4648-5-2X [0,2,0,0,0,0|2,0,0]=4 126 B11R1.23 COC(=O)C1=CC=NC(C)=N1 4H23-1-D2 [0,2,0,0,0,0|2,0,0]=4 127 B11R1.23 COC(=O)C1=CN=CC(C)=N1 4H58-1-ZY [0,2,0,0,0,0|0,0,0]=2 128 B11R1.23 NC1=CC=CC(C(=O)CBr)=C1 4656-9-0Q [0,2,0,0,0,0|2,0,0]=4 129 B11R1.222 CCC(=O)C1=CC=CC=C1Cl 2617-5-31 [0,2,0,0,0,0|2,0,0]=4 130 B11R1.222 COC(=O)C1=NC=CC=C1I 4H23-H-02 [0,2,0,0,0,0|1,0,0]=3 131 B11R1.222 COC(=O)C1=NC=NC=C1Br 4H58-9-2Z [0,2,0,0,0,0|2,0,0]=4 132 B11R1.155 CS(=O)(=O)C1=CC(Br)=CC=N1 8H63-9-12 [0,2,0,0,0,0|2,0,0]=4 133 B11R1.53 CNC1=CC=CC=C1C(C)=O 4631-1-0L [0,2,0,0,0,0|2,0,0]=4 134 B11R1.53 COC1=CC=CN=C1C(N)=O 4H48-1-094 [0,2,0,0,0,0|2,0,0]=4 135 B11R1.53 COC1=CC=NC=C1C(C)=O 4H17-1-4A [0,2,0,0,0,0|1,0,0]=3 136 B11R1.156 CC(=O)C1=C(C)C=CC=C1F 2617-3-0S [0,2,0,0,0,0|2,0,0]=4 137 B11R1.156 CC1=CC=NC(Cl)=C1C(N)=O 4H48-5-G9 [0,2,0,0,0,0|2,0,0]=4 138 B11R1.159 O=C(O)C1=CN=CC(Cl)=C1Cl 4H21-4-68 [0,2,0,0,0,0|2,0,0]=4 139 B11R1.167 CC(=O)C1=CC(O)=CC=C1Cl 2617-5-1F [0,2,0,0,0,0|2,0,0]=4 140 B11R1.167 CC1=NC=C(Cl)C=C1C(=O)O 4H58-5-5X [0,2,0,0,0,0|2,0,0]=4 141 B11R1.167 NC1=C(C(=O)O)N=C(Cl)C=N1 4H57-5-03 [0,2,0,0,0,0|1,0,0]=3 142 B11R1.74 CC1=CC(C(=O)O)=NC(Cl)=C1 4H21-5-19 [0,2,0,0,0,0|2,0,0]=4 143 B11R1.266 N#CC1=CC=NC(C(=O)O)=C1 4H58-1-DD [0,2,0,0,0,0|2,0,0]=4 144 B11R2.10 CC1=CC2=CC=NC=C2N1 3H32-1-A0 [0,0,0,1,0,1|2,0,0]=4 145 B11R2.10 O=C1CC2=C(C=NC=C2)N1 4H48-5-69 [0,0,0,1,0,1|1,0,0]=3 146 B11R2.10 O=C1CN2C=CC=CC2=N1 4H48-9-98 [0,0,0,1,0,1|1,0,1]=4 147 B11R2.1 CC1=NNC2=NC=CN=C12 3H31-1-5D [0,1,0,1,0,0|1,0,0]=3 148 B11R2.1 O=C1CCC2=NC=CC=C12 4H17-1-3K [0,1,0,1,0,0|1,0,0]=3 149 B11R2.1 O=C1NCC2=CC=NC=C12 4H48-1-AW [0,1,0,1,0,0|1,0,0]=3 150 B11R2.1 O=C1NCC2=NC=CC=C12 4H48-1-11 [0,1,0,1,0,0|1,0,0]=3 151 B7R1.1 CCC1=CSC=N1 7H70-1-2D [1,0,0,0,1,0|1,0,1]=4 152 B11R1.91 NC(=O)CCC1=CC=CC=N1 4H48-1-VK [0,0,0,0,0,2|2,0,0]=4 153 B11R1.91 NC(=O)CCC1=CC=CN=C1 4H48-1-VL [0,0,0,0,0,2|2,0,0]=4 154 B11R1.91 O=C(Cl)CCC1=CC=CN=C1 4H16-5-67 [0,0,0,0,0,2|2,0,0]=4 155 B11R1.91 O=C(O)C#CC1=CC=CC=N1 4H58-1-470 [0,0,0,0,0,2|2,0,0]=4 156 B11R1.91 O=C(O)C#CC1=CC=CN=C1 4H58-1-471 [0,0,0,0,0,2|2,0,0]=4