0 B10R1.18 CC(=O)NC1=CN=CC=C1 PHBB_SC-09615 [0,0,0,0,0,0|3,0,0]=3 1 B10R1.18 N=C(N)CC1=CC=CC=C1 PHBB_SC-08622 [0,0,0,0,0,0|2,0,0]=2 2 B10R1.18 NC(=S)NC1=CC=CC=C1 PHBB_SC-04815 [0,0,0,0,0,0|2,1,0]=3 3 B10R1.18 O=C(Cl)CC1=CC=CC=C1 PHBB_SC-04855 [0,0,0,0,0,0|1,0,0]=1 4 B10R1.18 O=C(Cl)OC1=CC=CC=C1 PHBB_SC-04902 [0,0,0,0,0,0|2,0,0]=2 5 B9R1.8 BrCCC1=CC=CC=C1 PHBB_SC-05006 [1,0,0,0,0,0|1,0,1]=3 6 B9R1.8 CCNC1=CC=CC=C1 PHBB_SC-05020 [1,0,0,0,0,0|2,0,1]=4 7 B9R1.8 CNCC1=CC=CC=C1 PHBB_SC-04966 [1,0,0,0,0,0|2,0,0]=3 8 B9R1.8 CNCC1=CC=CC=N1 PHBB_SC-10921 [1,0,0,0,0,0|3,0,0]=4 9 B9R1.8 COCC1=CC=CC=C1 PHBB_SC-05053 [1,0,0,0,0,0|2,0,0]=3 10 B9R1.8 ClCCC1=CC=CC=C1 PHBB_SC-03435 [1,0,0,0,0,0|1,0,1]=3 11 B9R1.8 N#CCC1=NC=CC=C1 PHBB_SC-03787 [1,0,0,0,0,0|2,0,1]=4 12 B9R1.8 NCCC1=CC=NC=C1 PHBB_SC-10402 [1,0,0,0,0,0|2,0,1]=4 13 B9R1.8 NNCC1=CC=CC=C1 PHBB_SC-04682 [1,0,0,0,0,0|2,0,0]=3 14 B9R1.8 O=C=NC1=CC=CC=C1 PHBB_SC-05015 [1,0,0,0,0,0|1,0,1]=3 15 B9R1.8 OCCC1=NC=CC=C1 PHBB_SC-11012 [1,0,0,0,0,0|1,0,1]=3 16 B9R1.8 S=C=NC1=CC=CC=C1 PHBB_SC-06210 [1,0,0,0,0,0|1,1,1]=4 17 B11R1.20 CC(=O)NC1=CC=C(N)C=C1 PHBB_SC-11299 [0,1,0,0,0,0|2,0,0]=3 18 B11R1.20 CC(=O)NC1=CC=C(O)C=C1 PHBB_SC-08449 [0,1,0,0,0,0|2,0,0]=3 19 B11R1.20 CC1=CC=C(NC(=S)[S-])C=C1 PHBB_SC-09592 [0,1,0,0,0,0|1,2,0]=4 20 B11R1.20 NC(=O)CC1=CC=C(O)C=C1 PHBB_NC-02045 [0,1,0,0,0,0|1,0,0]=2 21 B11R1.20 NC(=S)NC1=CC=C(O)C=C1 PHBB_SC-08163 [0,1,0,0,0,0|2,1,0]=4 22 B11R1.20 NC1=CC=C(CC(=O)O)C=C1 PHBB_NC-02220 [0,1,0,0,0,0|0,0,0]=1 23 B11R1.20 O=C(O)CC1=CC=C(Cl)C=C1 PHBB_SC-05295 [0,1,0,0,0,0|0,0,0]=1 24 B11R1.20 O=C(O)CC1=CC=C(O)C=C1 PHBB_NC-03010 [0,1,0,0,0,0|0,0,0]=1 25 B11R1.36 NC(C(=O)Cl)C1=CC=CC=C1 PHBB_NC-00237 [0,1,0,0,0,0|1,0,0]=2 26 B11R1.36 N[C@H](C(=O)O)C1=CC=CC=C1 PHBB_NC-03684 [0,1,0,0,0,0|0,0,0]=1 27 B11R1.36 O=C(O)C(O)C1=CC=CC=C1 PHBB_NC-02998 [0,1,0,0,0,0|0,0,0]=1 28 B11R1.36 O=C(O)[C@@H](O)C1=CC=CC=C1 PHBB_NC-03020 [0,1,0,0,0,0|0,0,0]=1 29 B11R1.40 COC(=O)CC1=CC=CC=C1 PHBB_SC-08463 [0,1,0,0,0,0|0,0,0]=1 30 B11R1.40 C\C(C=O)=C/C1=CC=CC=C1 PHBB_NC-02003 [0,1,0,0,0,0|1,0,1]=3 31 B11R1.40 NCC(=O)NC1=CC=NC=C1 PHBB_SC-06018 [0,1,0,0,0,0|3,0,0]=4 32 B11R1.40 NCC(=O)NC1=NC=CC=C1 PHBB_SC-06017 [0,1,0,0,0,0|3,0,0]=4 33 B11R1.40 N\C(CC1=CC=CC=C1)=N/O PHBB_SC-06055 [0,1,0,0,0,0|1,0,0]=2 34 B11R1.40 O=C(CS)NC1=CC=CC=C1 PHBB_SC-00200 [0,1,0,0,0,0|1,1,0]=3 35 B11R1.40 [C@H](N)(CO)CC1=CC=CC=C1 PHBB_SC-01477 [0,1,0,0,0,0|1,0,1]=3 36 B11R1.86 NC(=S)NC1=CC=CC=C1O PHBB_SC-04233 [0,1,0,0,0,0|2,1,0]=4 37 B11R1.86 O=C(O)CN1C=CC=CC1=O PHBB_NC-01486 [0,1,0,0,0,0|1,0,0]=2 38 B11R1.157 CC(=O)NC1=CC(N)=CC=C1 PHBB_SC-03037 [0,1,0,0,0,0|2,0,0]=3 39 B11R1.157 NC(=O)CC1=CC=CC(N)=C1 PHBB_SC-08709 [0,1,0,0,0,0|1,0,0]=2 40 B11R1.157 NC(=O)NC1=CC=CC(O)=C1 PHBB_SC-04043 [0,1,0,0,0,0|2,0,0]=3 41 B11R1.509 C[N+](C)(C)CC1=CC=CC=C1 PHBB_SC-05055 [0,1,0,0,0,0|3,0,0]=4 42 B11R1.509 O=S(=O)(Cl)CC1=CC=CC=C1 PHBB_SC-04756 [0,1,0,0,0,0|1,0,1]=3 43 B11R2.10 CC1=NC2=C(C=CC=C2)N1 PHBB_SC-04961 [0,0,0,1,0,0|3,0,0]=4 44 B11R2.10 ClC1=NC2=CC=CC=C2N1 PHBB_SC-01131 [0,0,0,1,0,0|3,0,0]=4 45 B11R2.10 NC1=NC2=C(C=CC=C2)S1 PHBB_SC-04837 [0,0,0,1,0,0|2,1,0]=4 46 B11R2.10 NC1=NC2=CC=CC=C2N1 PHBB_SC-07179 [0,0,0,1,0,0|3,0,0]=4 47 B11R2.10 O=C1CC2=C(C=CC=C2)N1 PHBB_SC-03590 [0,0,0,1,0,0|1,0,0]=2 48 B11R2.10 O=C1NC2=C(C=CC=C2)O1 PHBB_NC-03233 [0,0,0,1,0,0|1,0,0]=2 49 B11R2.10 O=C1NC2=C(N=CC=C2)N1 PHBB_SC-07859 [0,0,0,1,0,0|3,0,0]=4 50 B11R2.10 SC1=NC2=C(C=CC=C2)N1 PHBB_SC-04787 [0,0,0,1,0,0|2,1,0]=4 51 B11R2.10 SC1=NC2=C(C=CC=C2)O1 PHBB_SC-00028 [0,0,0,1,0,0|1,1,0]=3 52 B11R2.10 SC1=NC2=CC=CC=C2S1 PHBB_SC-04052 [0,0,0,1,0,0|1,2,0]=4 53 B9R1.6 CC(=O)C1=CC=CC=N1 PHBB_SC-04703 [0,0,0,0,1,0|2,0,0]=3 54 B9R1.6 CC(=O)C1=CC=NC=C1 PHBB_SC-12116 [0,0,0,0,1,0|2,0,0]=3 55 B9R1.6 CC(=O)C1=NC=CN=C1 PHBB_SC-12128 [0,0,0,0,1,0|3,0,0]=4 56 B9R1.6 C[C@@H](N)C1=CC=CC=C1 PHBB_NC-02025 [0,0,0,0,1,0|2,0,1]=4 57 B9R1.6 N=C(N)C1=CC=CC=C1 PHBB_SC-05168 [0,0,0,0,1,0|2,0,0]=3 58 B9R1.6 N=C(N)C1=CC=CN=C1 PHBB_SC-05278 [0,0,0,0,1,0|3,0,0]=4 59 B9R1.6 NC(=O)C1=CC=CN=C1 PHBB_NC-02021 [0,0,0,0,1,0|2,0,0]=3 60 B9R1.6 NC(=O)C1=CC=NC=C1 PHBB_SC-08367 [0,0,0,0,1,0|2,0,0]=3 61 B9R1.6 NC(=O)C1=CN=CC=N1 PHBB_SC-00823 [0,0,0,0,1,0|3,0,0]=4 62 B9R1.6 NC(=S)C1=CN=CC=C1 PHBB_SC-04028 [0,0,0,0,1,0|2,1,0]=4 63 B9R1.6 O=C(Cl)C1=CN=CC=C1 PHBB_SC-04877 [0,0,0,0,1,0|2,0,0]=3 64 B9R1.6 O=C(O)C1=CC=NC=C1 PHBB_SC-08475 [0,0,0,0,1,0|1,0,0]=2 65 B9R1.6 O=C(O)C1=CN=CC=N1 PHBB_SC-03976 [0,0,0,0,1,0|2,0,0]=3 66 B9R1.6 O=C([O-])C1=NC=CC=C1 PHBB_SC-05228 [0,0,0,0,1,0|1,0,1]=3 67 B9R1.13 O=C(Cl)CC1=CC=CS1 PHBB_SC-03499 [0,0,0,0,1,0|2,0,0]=3 68 B9R1.13 O=C(O)CC1=CSC=C1 PHBB_SC-11270 [0,0,0,0,1,0|1,0,0]=2 69 B9R1.13 O=C(O)CN1C=CC=N1 PHBB_SC-07786 [0,0,0,0,1,0|2,0,0]=3 70 B9R1.13 O=C(O)CN1C=CN=C1 PHBB_SC-05735 [0,0,0,0,1,0|2,0,0]=3 71 B11R1.91 CC(=O)CCC1=CC=CC=C1 PHBB_SC-04990 [0,0,0,0,0,1|1,0,0]=2 72 B11R1.91 CC(N)CCC1=CC=CC=C1 PHBB_NC-02029 [0,0,0,0,0,1|2,0,1]=4 73 B11R1.91 CC(O)C#CC1=CC=CC=C1 PHBB_SC-06989 [0,0,0,0,0,1|1,0,2]=4 74 B11R1.91 NC(=O)NCC1=CC=CC=C1 PHBB_SC-04678 [0,0,0,0,0,1|1,0,0]=2 75 B11R1.91 NC(=S)NNC1=CC=CC=C1 PHBB_SC-04739 [0,0,0,0,0,1|2,1,0]=4 76 B11R1.91 O=C(Cl)OCC1=CC=CC=C1 PHBB_SC-05183 [0,0,0,0,0,1|1,0,0]=2 77 B11R1.91 O=C(Cl)\C=C\C1=CC=CC=C1 PHBB_SC-04874 [0,0,0,0,0,1|1,0,1]=3 78 B11R1.91 O=C(O)C#CC1=CC=CC=C1 PHBB_SC-04745 [0,0,0,0,0,1|0,0,1]=2 79 B11R1.91 O=C(O)CCC1=CC=CC=C1 PHBB_NC-02947 [0,0,0,0,0,1|0,0,0]=1 80 B11R1.91 O=C(O)CNC1=CC=CC=C1 PHBB_NC-02179 [0,0,0,0,0,1|0,0,0]=1 81 B11R1.91 O=C(O)CNC1=NC=CC=N1 PHBB_NC-01871 [0,0,0,0,0,1|2,0,0]=3 82 B11R1.91 O=C(O)COC1=CC=CC=C1 PHBB_SC-04460 [0,0,0,0,0,1|0,0,0]=1 83 B11R1.91 O=C(O)COC1=CC=CN=C1 PHBB_SC-04343 [0,0,0,0,0,1|1,0,0]=2 84 B11R1.91 O=C(O)CSC1=NC=CC=N1 PHBB_SC-04436 [0,0,0,0,0,1|2,0,0]=3 85 B11R1.91 O=C(O)\C=C\C1=CC=CC=C1 PHBB_SC-12089 [0,0,0,0,0,1|0,0,1]=2 86 B8R1.2 C=CC1=CC=CC=N1 PHBB_SC-03996 [2,0,0,0,0,0|1,0,1]=4 87 B8R1.2 C=CC1=CC=NC=C1 PHBB_SC-04003 [2,0,0,0,0,0|1,0,1]=4 88 B8R1.2 ClCC1=CC=CC=N1 PHBB_SC-01935 [2,0,0,0,0,0|2,0,0]=4 89 B8R1.2 ClCC1=CC=CN=C1 PHBB_SC-01948 [2,0,0,0,0,0|2,0,0]=4 90 B8R1.2 ClCC1=CC=NC=C1 PHBB_SC-01947 [2,0,0,0,0,0|2,0,0]=4 91 B8R1.2 NCC1=CC=CC=N1 PHBB_SC-04231 [2,0,0,0,0,0|2,0,0]=4 92 B8R1.2 NCC1=CN=CC=C1 PHBB_SC-12218 [2,0,0,0,0,0|2,0,0]=4 93 B8R1.2 NNC1=CC=CC=C1 PHBB_SC-04844 [2,0,0,0,0,0|2,0,0]=4 94 B8R1.2 O=CC1=CC=CC=N1 PHBB_SC-05238 [2,0,0,0,0,0|1,0,0]=3 95 B8R1.2 O=CC1=CC=NC=C1 PHBB_SC-04827 [2,0,0,0,0,0|1,0,0]=3 96 B8R1.2 O=CC1=CN=CC=C1 PHBB_SC-11009 [2,0,0,0,0,0|1,0,0]=3 97 B8R1.2 OCC1=CC=CC=C1 PHBB_SC-05054 [2,0,0,0,0,0|0,0,0]=2 98 B10R1.1 NCCC1=CC=C(F)C=C1 PHBB_SC-04579 [1,1,0,0,0,0|1,0,1]=4 99 B10R1.1 NCCC1=CC=C(O)C=C1 PHBB_NC-02695 [1,1,0,0,0,0|1,0,1]=4 100 B10R1.1 O=C=NC1=CC=C(Cl)C=C1 PHBB_SC-04721 [1,1,0,0,0,0|1,0,1]=4 101 B10R1.4 C=CCC1=CC=CC=C1O PHBB_SC-00690 [1,1,0,0,0,0|1,0,0]=3 102 B10R1.4 O\N=C\C1=CC=CC=C1O PHBB_SC-04004 [1,1,0,0,0,0|1,0,1]=4 103 B10R1.10 CNCC1=CC(N)=CC=C1 PHBB_SC-05978 [1,1,0,0,0,0|2,0,0]=4 104 B10R1.10 NCCC1=CC(F)=CC=C1 PHBB_SC-05860 [1,1,0,0,0,0|1,0,1]=4 105 B10R1.10 O=C=NC1=CC(Cl)=CC=C1 PHBB_SC-04916 [1,1,0,0,0,0|1,0,1]=4 106 B10R1.15 N\C(=N/O)C1=CC=CC=C1 PHBB_SC-11990 [1,1,0,0,0,0|1,0,1]=4 107 B10R1.17 BrCCCC1=CC=CC=C1 PHBB_SC-08397 [1,1,0,0,0,0|1,0,1]=4 108 B10R1.17 CCCNC1=CC=CC=C1 PHBB_SC-00131 [1,1,0,0,0,0|1,0,1]=4 109 B10R1.17 CCNCC1=CC=CC=C1 PHBB_SC-05041 [1,1,0,0,0,0|1,0,1]=4 110 B10R1.17 ClC\C=C\C1=CC=CC=C1 PHBB_SC-04918 [1,1,0,0,0,0|1,0,1]=4 111 B10R1.17 NCCCC1=CC=CC=C1 PHBB_NC-02946 [1,1,0,0,0,0|1,0,1]=4 112 B10R1.17 NCCOC1=CC=CC=C1 PHBB_SC-08509 [1,1,0,0,0,0|1,0,1]=4 113 B10R1.17 NCCSC1=CC=CC=C1 PHBB_SC-09180 [1,1,0,0,0,0|1,0,1]=4 114 B10R1.17 OCCNC1=CC=CC=C1 PHBB_SC-05134 [1,1,0,0,0,0|0,0,1]=3 115 B10R1.17 OCCOC1=CC=CC=C1 PHBB_SC-01850 [1,1,0,0,0,0|0,0,1]=3 116 B10R1.17 OC\C=C\C1=CC=CC=C1 PHBB_NC-01992 [1,1,0,0,0,0|0,0,1]=3 117 B10R1.17 S=C=NCC1=CC=CC=C1 PHBB_SC-04723 [1,1,0,0,0,0|0,1,1]=4 118 B10R1.13 CC(=O)C1=CC=C(Br)C=C1 PHBB_SC-04795 [0,1,0,0,1,0|1,0,0]=3 119 B10R1.13 CC(=O)C1=CC=C(C)C=C1 PHBB_SC-04777 [0,1,0,0,1,0|1,0,0]=3 120 B10R1.13 CC(=O)C1=CC=C(Cl)C=C1 PHBB_SC-04839 [0,1,0,0,1,0|1,0,0]=3 121 B10R1.13 CC(=O)C1=CC=C(I)C=C1 PHBB_SC-05920 [0,1,0,0,1,0|1,0,0]=3 122 B10R1.13 CC(=O)C1=CC=C(N)C=C1 PHBB_SC-10498 [0,1,0,0,1,0|1,0,0]=3 123 B10R1.13 CC(=O)C1=CC=C(O)C=C1 PHBB_SC-04830 [0,1,0,0,1,0|1,0,0]=3 124 B10R1.13 CC1=CC=C(C(=O)Cl)C=C1 PHBB_SC-08420 [0,1,0,0,1,0|1,0,0]=3 125 B10R1.13 N=C(N)C1=CC=C(N)C=C1 PHBB_SC-05554 [0,1,0,0,1,0|2,0,0]=4 126 B10R1.13 NC(=O)C1=CC=C(N)C=C1 PHBB_SC-03765 [0,1,0,0,1,0|1,0,0]=3 127 B10R1.13 NC(=S)C1=CC=C(O)C=C1 PHBB_SC-02364 [0,1,0,0,1,0|1,1,0]=4 128 B10R1.13 NC1=CC=C(C(=O)O)C=N1 PHBB_SC-07843 [0,1,0,0,1,0|1,0,0]=3 129 B10R1.13 O=C(Cl)C1=CC=C(Cl)C=C1 PHBB_SC-04840 [0,1,0,0,1,0|1,0,0]=3 130 B10R1.13 O=C(O)C1=CC=C(F)C=C1 PHBB_SC-04695 [0,1,0,0,1,0|0,0,0]=2 131 B10R1.13 O=C(O)C1=CC=C(O)C=C1 PHBB_NC-02033 [0,1,0,0,1,0|0,0,0]=2 132 B10R1.13 O=C(O)C1=CN=C(Cl)C=C1 PHBB_SC-03319 [0,1,0,0,1,0|1,0,0]=3 133 B10R1.13 O=C1C=CC(C(=O)O)=CN1 PHBB_NC-02879 [0,1,0,0,1,0|1,0,0]=3 134 B10R1.13 O=C1C=CC(C(=O)O)=CO1 PHBB_NC-01962 [0,1,0,0,1,0|1,0,0]=3 135 B10R1.13 O=C1C=CC(C(=O)O)=NN1 PHBB_SC-02292 [0,1,0,0,1,0|2,0,0]=4 136 B10R1.13 O=[N+]([O-])C1=CC=C(Br)C=C1 PHBB_SC-04455 [0,1,0,0,1,0|1,0,1]=4 137 B10R1.13 O=[N+]([O-])C1=CC=C(Cl)C=C1 PHBB_SC-05119 [0,1,0,0,1,0|1,0,1]=4 138 B10R1.13 O=[N+]([O-])C1=CC=C(F)C=C1 PHBB_SC-03795 [0,1,0,0,1,0|1,0,1]=4 139 B10R1.28 NS(=O)(=O)C1=CC=CC=C1 PHBB_SC-05057 [0,1,0,0,1,0|1,0,1]=4 140 B10R1.61 CC(=O)C1=C(C)C=CC=C1 PHBB_SC-04946 [0,1,0,0,1,0|1,0,0]=3 141 B10R1.61 CC(=O)C1=C(O)C=CC=C1 PHBB_SC-04876 [0,1,0,0,1,0|1,0,0]=3 142 B10R1.61 CC(=O)C1=CC=CC=C1N PHBB_SC-06120 [0,1,0,0,1,0|1,0,0]=3 143 B10R1.61 CC1=C(C(=O)Cl)C=CC=C1 PHBB_SC-05005 [0,1,0,0,1,0|1,0,0]=3 144 B10R1.61 NC(=O)C1=C(O)C=CC=C1 PHBB_SC-06694 [0,1,0,0,1,0|1,0,0]=3 145 B10R1.61 NC(=O)C1=C(O)C=CC=N1 PHBB_SC-04037 [0,1,0,0,1,0|2,0,0]=4 146 B10R1.61 NC1=C(C(=O)O)C=CC=N1 PHBB_SC-03320 [0,1,0,0,1,0|1,0,0]=3 147 B10R1.61 NC1=C(C(=O)O)C=NC=N1 PHBB_NC-03064 [0,1,0,0,1,0|2,0,0]=4 148 B10R1.61 NC1=CC=CC=C1C(=O)O PHBB_NC-03334 [0,1,0,0,1,0|0,0,0]=2 149 B10R1.61 NC1=CC=CC=C1[N+](=O)[O-] PHBB_SC-10499 [0,1,0,0,1,0|1,0,1]=4 150 B10R1.61 O=C(Cl)C1=C(Cl)C=CC=C1 PHBB_SC-04912 [0,1,0,0,1,0|1,0,0]=3 151 B10R1.61 O=C(Cl)C1=C(F)C=CC=C1 PHBB_SC-08434 [0,1,0,0,1,0|1,0,0]=3 152 B10R1.61 O=C(Cl)C1=CC=CN=C1Cl PHBB_SC-05862 [0,1,0,0,1,0|2,0,0]=4 153 B10R1.61 O=C(O)C1=C(I)C=CC=C1 PHBB_SC-04862 [0,1,0,0,1,0|0,0,0]=2 154 B10R1.61 O=C(O)C1=CC=CC=C1F PHBB_SC-09608 [0,1,0,0,1,0|0,0,0]=2 155 B10R1.61 O=C(O)C1=CC=CN=C1Cl PHBB_SC-04606 [0,1,0,0,1,0|1,0,0]=3 156 B10R1.61 O=C(O)C1=CC=CN=C1S PHBB_SC-04731 [0,1,0,0,1,0|1,0,0]=3 157 B10R1.61 O=C(O)C1=CC=CNC1=O PHBB_NC-01907 [0,1,0,0,1,0|1,0,0]=3 158 B10R1.113 CC(=O)C1=CC(O)=CC=C1 PHBB_SC-05199 [0,1,0,0,1,0|1,0,0]=3 159 B10R1.113 CC(=O)C1=CC=CC(N)=C1 PHBB_SC-10497 [0,1,0,0,1,0|1,0,0]=3 160 B10R1.113 NC(=O)C1=CC(Cl)=NC=C1 PHBB_SC-09755 [0,1,0,0,1,0|2,0,0]=4 161 B10R1.113 NC(=O)C1=CC=CC(N)=C1 PHBB_SC-08569 [0,1,0,0,1,0|1,0,0]=3 162 B10R1.113 NC(=O)C1=NC(Cl)=CC=C1 PHBB_SC-04469 [0,1,0,0,1,0|2,0,0]=4 163 B10R1.113 NC1=CC(C(=O)O)=CN=C1 PHBB_SC-03701 [0,1,0,0,1,0|1,0,0]=3 164 B10R1.113 NC1=CC=CC(C(=O)O)=C1 PHBB_SC-12098 [0,1,0,0,1,0|0,0,0]=2 165 B10R1.113 NC1=NC=CC(C(=O)O)=C1 PHBB_SC-07844 [0,1,0,0,1,0|1,0,0]=3 166 B10R1.113 O=C(O)C1=CC(Br)=CN=C1 PHBB_SC-02168 [0,1,0,0,1,0|1,0,0]=3 167 B10R1.113 O=C(O)C1=CC(Cl)=CC=N1 PHBB_SC-07057 [0,1,0,0,1,0|1,0,0]=3 168 B10R1.113 O=C(O)C1=CC(Cl)=NC=C1 PHBB_SC-03500 [0,1,0,0,1,0|1,0,0]=3 169 B10R1.113 O=C(O)C1=CC(O)=CN=C1 PHBB_NC-01786 [0,1,0,0,1,0|1,0,0]=3 170 B10R1.113 O=C(O)C1=CC=CC(O)=C1 PHBB_SC-04677 [0,1,0,0,1,0|0,0,0]=2 171 B10R1.113 O=C(O)C1=C[N+]([O-])=CC=C1 PHBB_SC-04887 [0,1,0,0,1,0|1,0,0]=3 172 B10R1.113 O=C(O)C1=NC(Cl)=CC=C1 PHBB_SC-03322 [0,1,0,0,1,0|1,0,0]=3 173 B10R1.113 O=C(O)C1=NC(O)=CC=C1 PHBB_SC-03565 [0,1,0,0,1,0|1,0,0]=3 174 B10R1.23 C[C@@H](C(=O)O)N1C=CC=C1 PHBB_NC-03701 [0,1,0,0,1,0|1,0,0]=3 175 B10R1.27 CCC(=O)CC1=CC=CO1 PHBB_NC-02316 [0,1,0,0,1,0|2,0,0]=4 176 B10R1.27 COC(=O)CN1C=CC=N1 PHBB_SC-09916 [0,1,0,0,1,0|2,0,0]=4 177 B10R1.27 COC(=O)CN1C=CN=C1 PHBB_SC-10118 [0,1,0,0,1,0|2,0,0]=4 178 B10R1.54 CC1=CN(CC(=O)O)N=C1 PHBB_SC-07348 [0,1,0,0,1,0|2,0,0]=4 179 B10R1.54 CC1=NC(CC(=O)O)=CS1 PHBB_SC-07641 [0,1,0,0,1,0|2,0,0]=4 180 B10R1.54 CC1=NN(CC(=O)O)C=C1 PHBB_SC-04409 [0,1,0,0,1,0|2,0,0]=4 181 B10R1.54 NC1=NC(CC(=O)O)=CS1 PHBB_SC-02942 [0,1,0,0,1,0|2,0,0]=4 182 B10R1.54 O=C(O)CC1=CC(=O)NN1 PHBB_SC-11600 [0,1,0,0,1,0|2,0,0]=4 183 B10R1.54 O=C(O)CN1C=C(Br)C=N1 PHBB_SC-09321 [0,1,0,0,1,0|2,0,0]=4 184 B10R1.54 O=C(O)CN1C=C(I)C=N1 PHBB_SC-12129 [0,1,0,0,1,0|2,0,0]=4 185 B10R1.64 CC1=CC=NN1CC(=O)O PHBB_SC-04514 [0,1,0,0,1,0|2,0,0]=4 186 B10R1.64 CC1=NC=CN1CC(=O)O PHBB_SC-04272 [0,1,0,0,1,0|2,0,0]=4 187 B10R1.64 N=C1SC=CN1CC(=O)O PHBB_SC-03822 [0,1,0,0,1,0|2,0,0]=4 188 B10R1.64 O=C(O)CC1=CNN=C1O PHBB_SC-10146 [0,1,0,0,1,0|2,0,0]=4 189 B12R1.21 CC(=O)CCC1=CC=C(O)C=C1 PHBB_NC-00157 [0,1,0,0,0,1|1,0,0]=3 190 B12R1.21 NC(=O)COC1=CC=C(N)C=C1 PHBB_SC-05284 [0,1,0,0,0,1|1,0,0]=3 191 B12R1.21 NC1=CC=C(CCC(=O)O)C=C1 PHBB_NC-03346 [0,1,0,0,0,1|0,0,0]=2 192 B12R1.21 NC1=CC=C(OCC(=O)O)C=C1 PHBB_SC-06933 [0,1,0,0,0,1|0,0,0]=2 193 B12R1.21 O=C(O)CCC1=CC=C(O)C=C1 PHBB_NC-00016 [0,1,0,0,0,1|0,0,0]=2 194 B12R1.21 O=C(O)CNC1=CC=C(O)C=C1 PHBB_NC-03501 [0,1,0,0,0,1|0,0,0]=2 195 B12R1.21 O=C(O)\C=C\C1=CC=C(O)C=C1 PHBB_NC-01994 [0,1,0,0,0,1|0,0,1]=3 196 B12R1.27 COC(=O)CNC1=CC=CC=C1 PHBB_SC-11456 [0,1,0,0,0,1|0,0,0]=2 197 B12R1.27 N\C(COC1=CC=CC=C1)=N/O PHBB_SC-09407 [0,1,0,0,0,1|1,0,0]=3 198 B12R1.43 CC(OC1=CC=CC=C1)C(=O)Cl PHBB_SC-08421 [0,1,0,0,0,1|1,0,0]=3 199 B12R1.43 NC(=O)[C@@H](N)CC1=CC=CC=C1 PHBB_NC-02068 [0,1,0,0,0,1|1,0,0]=3 200 B12R1.43 NC(CC1=CN=CC=C1)C(=O)O PHBB_NC-03785 [0,1,0,0,0,1|1,0,0]=3 201 B12R1.43 N[C@H](CC1=CN=CC=C1)C(=O)O PHBB_NC-03825 [0,1,0,0,0,1|1,0,0]=3 202 B12R1.107 CC(=O)CC(=O)C1=CC=CC=C1 PHBB_SC-01239 [0,1,0,0,0,1|1,0,0]=3 203 B12R1.107 CC(=O)CC(O)C1=NC=CC=C1 PHBB_NC-02252 [0,1,0,0,0,1|2,0,0]=4 204 B12R1.107 CN(CC(=O)O)C1=NC=CC=N1 PHBB_SC-11196 [0,1,0,0,0,1|2,0,0]=4 205 B12R1.107 NC(CC(=O)O)C1=CC=CC=C1 PHBB_NC-01892 [0,1,0,0,0,1|0,0,0]=2 206 B12R1.125 NC(=S)NCC1=C(Cl)C=CC=C1 PHBB_SC-05432 [0,1,0,0,0,1|1,1,0]=4 207 B12R1.125 O=C(O)CCC1=C(Cl)C=CC=C1 PHBB_SC-06228 [0,1,0,0,0,1|0,0,0]=2 208 B12R1.125 O=C(O)CNC1=C(F)C=CC=C1 PHBB_SC-08515 [0,1,0,0,0,1|0,0,0]=2 209 B12R1.125 O=C(O)COC1=C(Cl)C=CC=C1 PHBB_SC-05592 [0,1,0,0,0,1|0,0,0]=2 210 B12R1.125 O=C(O)\C=C\C1=C(O)C=CC=C1 PHBB_NC-02010 [0,1,0,0,0,1|0,0,1]=3 211 B12R1.226 NC1=CC=CC(CCC(=O)[O-])=C1 PHBB_SC-11189 [0,1,0,0,0,1|0,0,1]=3 212 B12R1.226 NC1=CC=CC(OCC(=O)O)=C1 PHBB_SC-05364 [0,1,0,0,0,1|0,0,0]=2 213 B12R1.226 O=C(O)\C=C\C1=CC=CC(O)=C1 PHBB_NC-01993 [0,1,0,0,0,1|0,0,1]=3 214 B12R1.4 COC1=CC=C(CC(=O)O)C=C1 PHBB_SC-03284 [0,2,0,0,0,0|0,0,0]=2 215 B12R1.4 COC1=CC=C(CC(C)=O)C=C1 PHBB_NC-01943 [0,2,0,0,0,0|1,0,0]=3 216 B12R1.4 COC1=CC=C(NC(N)=O)C=C1 PHBB_SC-04813 [0,2,0,0,0,0|2,0,0]=4 217 B12R1.20 NC(=O)[C@H](N)C1=CC=C(O)C=C1 PHBB_SC-09673 [0,2,0,0,0,0|1,0,0]=3 218 B12R1.20 N[C@@H](C(=O)O)C1=CC=C(O)C=C1 PHBB_NC-02929 [0,2,0,0,0,0|0,0,0]=2 219 B12R1.49 CNC(=O)CC1=CC=C(N)C=C1 PHBB_SC-08935 [0,2,0,0,0,0|1,0,0]=3 220 B12R1.49 N\C(CC1=CC=C(Cl)C=C1)=N/O PHBB_SC-06056 [0,2,0,0,0,0|1,0,0]=3 221 B12R1.233 CC1=NC(O)=C(CC(=O)O)C=N1 PHBB_SC-10268 [0,2,0,0,0,0|2,0,0]=4 222 B12R1.233 NC1=NC=C(CC(=O)O)C(O)=N1 PHBB_NC-01787 [0,2,0,0,0,0|2,0,0]=4 223 B12R1.233 O=C(O)CN1C=CC(=O)NC1=O PHBB_NC-02141 [0,2,0,0,0,0|2,0,0]=4 224 B12R1.34 CN(C(=O)CN)C1=CC=CC=C1 PHBB_SC-05689 [0,2,0,0,0,0|2,0,0]=4 225 B12R1.34 COC(=O)C(O)C1=CC=CC=C1 PHBB_NC-02032 [0,2,0,0,0,0|0,0,0]=2 226 B12R1.478 CCC(C(=O)O)C1=CC=CC=C1 PHBB_NC-01961 [0,2,0,0,0,0|0,0,0]=2 227 B12R1.478 O=C(O)C(CO)C1=CC=CC=C1 PHBB_NC-01813 [0,2,0,0,0,0|0,0,0]=2 228 B12R1.32 CCOC(=O)NC1=CC=CC=C1 PHBB_SC-04821 [0,2,0,0,0,0|1,0,0]=3 229 B12R1.32 NCCC(=O)NC1=CC=CC=C1 PHBB_SC-08941 [0,2,0,0,0,0|2,0,0]=4 230 B12R1.50 CNC(=O)CC1=CC=CC(N)=C1 PHBB_SC-08710 [0,2,0,0,0,0|1,0,0]=3 231 B12R1.50 NCC(=O)NC1=CC=CC(Cl)=C1 PHBB_SC-05652 [0,2,0,0,0,0|2,0,0]=4 232 B12R1.118 COC(CC1=CC=CC=C1)OC PHBB_SC-05116 [0,2,0,0,0,0|0,0,2]=4 233 B12R1.371 NCC(=O)NC1=CC=CC=C1Cl PHBB_SC-05845 [0,2,0,0,0,0|2,0,0]=4 234 B12R1.75 COC1=CC=CC=C1CC(C)=O PHBB_NC-02988 [0,2,0,0,0,0|1,0,0]=3 235 B12R1.127 CC(=O)NC1=CC(N)=CC=C1Cl PHBB_SC-09963 [0,2,0,0,0,0|2,0,0]=4 236 B12R1.127 CC(=O)NC1=CC(N)=CC=C1O PHBB_SC-10968 [0,2,0,0,0,0|2,0,0]=4 237 B12R1.127 O=C(O)CN1N=C(Cl)C=CC1=O PHBB_SC-09811 [0,2,0,0,0,0|2,0,0]=4 238 B12R1.127 O=C(O)CN1NC(=O)C=CC1=O PHBB_SC-03804 [0,2,0,0,0,0|2,0,0]=4 239 B12R1.101 O=C(O)CC1=CC(F)=CC(F)=C1 PHBB_SC-03006 [0,2,0,0,0,0|0,0,0]=2 240 B10R1.66 O=C(O)CCC1=CC=CO1 PHBB_NC-01695 [0,0,1,1,0,0|1,0,1]=4 241 B10R1.66 O=C(O)CCN1C=CC=C1 PHBB_SC-11852 [0,0,1,1,0,0|1,0,1]=4 242 B10R1.66 O=C(O)\C=C\C1=CC=CO1 PHBB_NC-02375 [0,0,1,1,0,0|1,0,1]=4 243 B10R2.6 C1=CC=C(C2CO2)C=C1 PHBB_NC-02009 [1,0,0,1,0,0|0,0,1]=3 244 B10R2.7 C1=CC2=C(C=C1)NC=C2 PHBB_NC-01977 [1,0,0,1,0,0|1,0,1]=4 245 B10R2.7 C1=CC=C2NCCC2=C1 PHBB_SC-00310 [1,0,0,1,0,0|1,0,1]=4 246 B12R2.24 NC1=NC2=CC=CC=C2SC1 PHBB_SC-09633 [0,0,0,1,0,1|2,0,0]=4 247 B12R2.24 O=C1C=CC2=C(C=CC=C2)O1 PHBB_NC-00341 [0,0,0,1,0,1|0,0,1]=3 248 B12R2.24 O=C1CCC2=C(C=CC=C2)O1 PHBB_NC-00687 [0,0,0,1,0,1|0,0,0]=2 249 B12R2.24 O=C1CSC2=C(C=CC=C2)N1 PHBB_SC-11805 [0,0,0,1,0,1|1,0,0]=3 250 B12R2.2057 C1=CC=C(OCC2CO2)C=C1 PHBB_SC-04053 [0,0,0,1,0,1|1,0,1]=4 251 B12R2.606 NC1=CC=C2NC(=O)NC2=C1 PHBB_SC-11037 [0,1,0,1,0,0|2,0,0]=4 252 B12R2.606 O=C1CC2=CC(Cl)=CC=C2N1 PHBB_SC-03714 [0,1,0,1,0,0|1,0,0]=3 253 B12R2.606 O=C1CC2=CC(F)=CC=C2N1 PHBB_SC-03903 [0,1,0,1,0,0|1,0,0]=3 254 B12R2.606 O=C1CC2=CC=C(Cl)C=C2N1 PHBB_SC-01135 [0,1,0,1,0,0|1,0,0]=3 255 B12R2.606 O=C1OC2=C(C=CC(O)=C2)S1 PHBB_SC-09777 [0,1,0,1,0,0|1,0,0]=3 256 B12R2.606 O=C1OC2=CC=C(O)C=C2S1 PHBB_SC-03950 [0,1,0,1,0,0|1,0,0]=3 257 B12R2.18 NC1C(=O)NC2=CC=CC=C21 PHBB_NC-02944 [0,1,0,1,0,0|1,0,0]=3 258 B12R2.18 NC1C(=O)NC2=CC=CC=C21 PHBB_NC-03448 [0,1,0,1,0,0|1,0,0]=3 259 B12R2.18 O=C1NC2=C(C=CC=C2)C1=O PHBB_NC-01952 [0,1,0,1,0,0|1,0,1]=4 260 B12R2.32 NCC1CC2=CC=CC=C2O1 PHBB_SC-07229 [0,1,0,1,0,0|1,0,1]=4 261 B12R2.32 O=CC1=NC2=CC=CC=C2N1 PHBB_SC-09909 [0,1,0,1,0,0|2,0,0]=4 262 B12R2.32 OCC1=NC2=C(C=CC=C2)N1 PHBB_SC-07083 [0,1,0,1,0,0|2,0,0]=4 263 B12R2.32 OCC1CC2=CC=CC=C2O1 PHBB_SC-01602 [0,1,0,1,0,0|0,0,2]=4 264 B8R1.7 CC(=O)C1=CC=CN1 PHBB_SC-02946 [0,0,0,0,2,0|2,0,0]=4 265 B8R1.7 O=C(Cl)C1=CC=CS1 PHBB_SC-04856 [0,0,0,0,2,0|2,0,0]=4 266 B8R1.7 O=C(O)C1=CC=CN1 PHBB_SC-10263 [0,0,0,0,2,0|1,0,0]=3 267 B8R1.7 O=C(O)C1=CC=CO1 PHBB_SC-04684 [0,0,0,0,2,0|1,0,0]=3 268 B8R1.7 O=C(O)C1=CC=NN1 PHBB_SC-04604 [0,0,0,0,2,0|2,0,0]=4 269 B8R1.7 O=C(O)C1=NNC=C1 PHBB_SC-06674 [0,0,0,0,2,0|2,0,0]=4 270 B8R1.7 OC(=O)C1=CSC=C1 PHBB_SC-06117 [0,0,0,0,2,0|1,0,0]=3 271 B12R1.252 O=C(O)CCNC1=NC=CC=N1 PHBB_NC-02965 [0,0,0,0,0,2|2,0,0]=4 272 B12R1.252 O=C(O)CSCC1=CC=CC=C1 PHBB_SC-04791 [0,0,0,0,0,2|0,0,0]=2 273 B12R1.252 O=C([O-])\C=C\SC1=CC=CC=C1 PHBB_SC-00182 [0,0,0,0,0,2|0,0,2]=4