0 B14R2.781 CC(=O)C1=CC2=C(C=C1)NCCC2 82932 [0,0,0,0,0,0|1,0,3]=4 1 B14R2.781 CC(=O)C1=CC2=CC=CC=C2C=N1 78893 [0,0,0,0,0,0|1,0,0]=1 2 B14R2.781 CC(=O)C1=CC2=CC=NC=C2C=C1 72316 [0,0,0,0,0,0|1,0,0]=1 3 B14R2.781 CC(=O)C1=CC2=CN=CC=C2C=C1 78509 [0,0,0,0,0,0|1,0,0]=1 4 B14R2.781 CC(=O)C1=CC2=NC=CN=C2C=C1 92476 [0,0,0,0,0,0|2,0,0]=2 5 B14R2.781 CC(=O)C1=NC2=CC=CC=C2C=C1 F30326 [0,0,0,0,0,0|1,0,0]=1 6 B14R2.781 CN(C)C1=CC2=CC=CC=C2C=C1 T70630 [0,0,0,0,0,0|2,0,0]=2 7 B14R2.781 C[C@H](N)C1=CC2=CC=CC=C2C=C1 F16860 [0,0,0,0,0,0|1,0,1]=2 8 B14R2.781 C[C@H](O)C1=CC2=CC=CC=C2C=C1 R10069 [0,0,0,0,0,0|0,0,2]=2 9 B14R2.781 C[C@H](O)C1=CC2=CC=CC=C2C=C1 T72566 [0,0,0,0,0,0|0,0,2]=2 10 B14R2.781 C[C@H](O)C1=CC2=CC=CN=C2C=C1 86452 [0,0,0,0,0,0|1,0,2]=3 11 B14R2.781 C[C@H](O)C1=CC2=NC=CC=C2C=C1 92481 [0,0,0,0,0,0|1,0,2]=3 12 B14R2.781 C[C@H](O)C1=CC2=NC=CN=C2C=C1 92477 [0,0,0,0,0,0|2,0,2]=4 13 B14R2.781 FC(F)C1=CC2=NC=CC=C2C=C1 W11264 [0,0,0,0,0,0|3,0,1]=4 14 B14R2.781 N=C(N)C1=CC2=CC=CC=C2C=N1 I11900 [0,0,0,0,0,0|3,0,0]=3 15 B14R2.781 N=C(N)C1=NC2=CC=CC=C2C=C1 W12202 [0,0,0,0,0,0|3,0,0]=3 16 B14R2.781 N=C(N)C1=NC2=CC=NC=C2C=C1 C71573 [0,0,0,0,0,0|4,0,0]=4 17 B14R2.781 NC(=O)C1=CC2=CC=CC=C2C=N1 11947 [0,0,0,0,0,0|2,0,0]=2 18 B14R2.781 NC(=O)C1=CC2=CC=NC=C2C=C1 O11834 [0,0,0,0,0,0|2,0,0]=2 19 B14R2.781 NC(=O)C1=NC2=CC=CC=C2C=C1 D83418 [0,0,0,0,0,0|2,0,0]=2 20 B14R2.781 O=C(Cl)C1=CC2=CC=CN=C2C=C1 AR3746 [0,0,0,0,0,0|2,0,0]=2 21 B14R2.781 O=C(O)C1=CC2=CC=CN=C2N=C1 C71198 [0,0,0,0,0,0|3,0,0]=3 22 B14R2.781 O=C(O)C1=CC2=CC=NC=C2C=C1 62874 [0,0,0,0,0,0|2,0,0]=2 23 B14R2.781 O=C(O)C1=CC2=CC=NC=C2N=C1 C13312 [0,0,0,0,0,0|3,0,0]=3 24 B14R2.781 O=C(O)C1=CC2=CN=CC=C2C=C1 H10545 [0,0,0,0,0,0|2,0,0]=2 25 B14R2.781 O=C(O)C1=CC2=CN=CC=C2N=C1 K10111 [0,0,0,0,0,0|3,0,0]=3 26 B14R2.781 O=C(O)C1=CC2=CN=CN=C2C=C1 CS1518 [0,0,0,0,0,0|3,0,0]=3 27 B14R2.781 O=C(O)C1=CC2=NC=CC=C2N=C1 A11739 [0,0,0,0,0,0|3,0,0]=3 28 B14R2.781 O=C(O)C1=CC2=NC=NC=C2C=C1 37066 [0,0,0,0,0,0|3,0,0]=3 29 B14R2.781 O=C(O)C1=NC2=CC=CN=C2C=C1 P10420 [0,0,0,0,0,0|3,0,0]=3 30 B14R2.781 O=C(O)C1=NC2=NC=CC=C2C=C1 H10544 [0,0,0,0,0,0|3,0,0]=3 31 B14R2.781 O=[N+]([O-])C1=CC2=CC=CC=C2N=C1 O11041 [0,0,0,0,0,0|3,0,0]=3 32 B14R2.781 O=[N+]([O-])C1=CC2=CN=CC=C2C=C1 87668 [0,0,0,0,0,0|3,0,0]=3 33 B14R2.781 O=[N+]([O-])C1=CC2=CN=NC=C2C=C1 96286 [0,0,0,0,0,0|4,0,0]=4 34 B14R2.781 O=[N+]([O-])C1=CC2=NC=NC=C2C=C1 C76413 [0,0,0,0,0,0|4,0,0]=4 35 B14R2.781 OB(O)C1=CC2=CC=NC=C2C=C1 25432 [0,0,0,0,0,0|3,0,1]=4 36 B14R2.781 OB(O)C1=CC2=CN=CC=C2C=C1 24388 [0,0,0,0,0,0|3,0,1]=4 37 B13R2.57 BrCC1=CC2=CC=CN=C2C=C1 O11502 [1,0,0,0,0,0|2,0,1]=4 38 B13R2.57 BrCC1=CC2=CC=NC=C2C=C1 78906 [1,0,0,0,0,0|2,0,1]=4 39 B13R2.57 C#CC1=CC2=CC=CC=C2N=C1 D76283 [1,0,0,0,0,0|1,0,2]=4 40 B13R2.57 C#CC1=CC=C2N=CC=CC2=C1 C76516 [1,0,0,0,0,0|1,0,2]=4 41 B13R2.57 C=CC1=CC=C2N=CN=CC2=C1 W11086 [1,0,0,0,0,0|2,0,1]=4 42 B13R2.57 C=CC1=NC2=CC=CC=C2C=C1 80295 [1,0,0,0,0,0|1,0,1]=3 43 B13R2.57 COC1=CC2=CC=NC=C2C=N1 66261 [1,0,0,0,0,0|3,0,0]=4 44 B13R2.57 COC1=CC2=NC=CC=C2C=C1 31891 [1,0,0,0,0,0|2,0,0]=3 45 B13R2.57 COC1=NC2=CC=CC=C2C=C1 W11244 [1,0,0,0,0,0|2,0,0]=3 46 B13R2.57 ClCC1=CC2=CC=CC=C2C=N1 C72814 [1,0,0,0,0,0|2,0,1]=4 47 B13R2.57 ClCC1=CC2=CC=CN=C2C=C1 70964 [1,0,0,0,0,0|2,0,1]=4 48 B13R2.57 ClCC1=NC2=CC=CC=C2C=C1 S11826 [1,0,0,0,0,0|2,0,1]=4 49 B13R2.57 N#CC1=CC2=NC=CC=C2C=C1 79349 [1,0,0,0,0,0|2,0,1]=4 50 B13R2.57 NCC1=CC2=CC=CC=C2C=N1 27594 [1,0,0,0,0,0|2,0,1]=4 51 B13R2.57 NCC1=CC2=CC=CC=C2C=N1 C73130 [1,0,0,0,0,0|2,0,1]=4 52 B13R2.57 NCC1=CC2=CC=CC=C2N=C1 C15569 [1,0,0,0,0,0|2,0,1]=4 53 B13R2.57 NCC1=CC=C2C=CC=NC2=C1 78919 [1,0,0,0,0,0|2,0,1]=4 54 B13R2.57 NCC1=CC=C2C=NC=CC2=C1 79154 [1,0,0,0,0,0|2,0,1]=4 55 B13R2.57 NCC1=NC2=CC=CC=C2C=C1 78918 [1,0,0,0,0,0|2,0,1]=4 56 B13R2.57 O=CC1=CC2=CC=NC=C2C=C1 AT15535 [1,0,0,0,0,0|1,0,0]=2 57 B13R2.57 O=CC1=CC2=CN=CC=C2C=C1 26625 [1,0,0,0,0,0|1,0,0]=2 58 B13R2.57 O=CC1=CC2=NC=CC=C2C=C1 24417 [1,0,0,0,0,0|1,0,0]=2 59 B13R2.57 O=CC1=CC2=NC=CN=C2C=C1 25704 [1,0,0,0,0,0|2,0,0]=3 60 B13R2.57 OCC1=CC2=CC=NC=C2C=C1 24141 [1,0,0,0,0,0|1,0,2]=4 61 B13R2.57 OCC1=NC2=CC=CC=C2C=C1 BL002914 [1,0,0,0,0,0|1,0,2]=4 62 B15R2.627 O=C(O)C1=C(O)C2=NC=CC=C2C=C1 62329 [0,1,0,0,0,0|2,0,0]=3 63 B15R2.627 O=C(O)C1=C(O)C2=NC=CC=C2N=C1 64519 [0,1,0,0,0,0|3,0,0]=4 64 B15R2.627 O=C(O)C1=COC2=C(C=CC=C2)C1=O A12476 [0,1,0,0,0,0|2,0,0]=3 65 B15R2.627 O=[N+]([O-])C1=C(Cl)C2=CC=CN=C2C=C1 55703 [0,1,0,0,0,0|3,0,0]=4 66 B15R2.627 O=[N+]([O-])C1=C(O)C2=CC=CN=C2C=C1 F13931 [0,1,0,0,0,0|3,0,0]=4 67 B15R2.984 CC(=O)C1=CC2=C(C=CC=C2)NC1=O 72022 [0,1,0,0,0,0|1,0,0]=2 68 B15R2.984 CC(=O)C1=CC2=C(C=CN=C2)NC1=O 79617 [0,1,0,0,0,0|2,0,0]=3 69 B15R2.984 CC(=O)C1=CC2=CC=CC=C2C=C1O W11378 [0,1,0,0,0,0|0,0,0]=1 70 B15R2.984 CC1=NC2=CC=CC=C2C=C1C(=O)O 88467 [0,1,0,0,0,0|2,0,0]=3 71 B15R2.984 CC1=NC2=CC=CC=C2N=C1C(=O)O C76365 [0,1,0,0,0,0|3,0,0]=4 72 B15R2.984 NC(=O)C1=CC2=CC=CC=C2C=C1N C74429 [0,1,0,0,0,0|1,0,0]=2 73 B15R2.984 NC1=CC2=CC=CC=C2N=C1C(=O)O O10947 [0,1,0,0,0,0|2,0,0]=3 74 B15R2.984 NC1=NC2=CC=CC=C2C=C1C(=O)O AC1535 [0,1,0,0,0,0|2,0,0]=3 75 B15R2.984 O=C(Cl)C1=CC2=CC=CC=C2N=C1Cl 30266 [0,1,0,0,0,0|2,0,0]=3 76 B15R2.984 O=C(O)C1=CC2=CC=CC=C2C=C1I W19073 [0,1,0,0,0,0|1,0,0]=2 77 B15R2.984 O=C(O)C1=CC2=CC=CN=C2NC1=O Y10350 [0,1,0,0,0,0|3,0,0]=4 78 B15R2.984 O=C(O)C1=NC2=CC=CC=C2C=C1O D83313 [0,1,0,0,0,0|2,0,0]=3 79 B15R2.984 O=C(O)C1=NC2=CC=CC=C2N=C1Cl 59685 [0,1,0,0,0,0|3,0,0]=4 80 B15R2.984 O=[N+]([O-])C1=CC2=CC=CC=C2N=C1Cl AC9771 [0,1,0,0,0,0|3,0,0]=4 81 B15R2.984 O=[N+]([O-])C1=CC2=CC=CN=C2C=C1Cl F11870 [0,1,0,0,0,0|3,0,0]=4 82 B15R2.1601 C=CC(=O)C1=CC2=CC=CC=C2C=C1 42547 [0,1,0,0,0,0|0,0,1]=2 83 B15R2.1601 CCC(=O)C1=CC2=CC=CC=C2C=C1 Y11687 [0,1,0,0,0,0|0,0,0]=1 84 B15R2.1601 CC[C@H](N)C1=CC2=CC=CC=C2C=C1 N10725 [0,1,0,0,0,0|1,0,1]=3 85 B15R2.1601 CC[C@H](N)C1=CC2=CC=CC=C2C=C1 N10727 [0,1,0,0,0,0|1,0,1]=3 86 B15R2.1601 CC[C@H](N)C1=CC2=CC=CC=C2C=C1 Y11453 [0,1,0,0,0,0|1,0,1]=3 87 B15R2.1601 CC[C@H](N)C1=CC2=CC=CC=C2C=C1 Y12038 [0,1,0,0,0,0|1,0,1]=3 88 B15R2.1601 CC[C@H](N)C1=CC2=CC=CC=C2C=C1 Y12599 [0,1,0,0,0,0|1,0,1]=3 89 B15R2.1601 COC(=O)C1=CC2=C(C=CC=C2)CC1 W11170 [0,1,0,0,0,0|0,0,2]=3 90 B15R2.1601 COC(=O)C1=CC2=CC=CC=C2N=C1 52869 [0,1,0,0,0,0|1,0,0]=2 91 B15R2.1601 COC(=O)C1=CC2=CN=CN=C2C=C1 P10101 [0,1,0,0,0,0|2,0,0]=3 92 B15R2.1601 COC(=O)C1=CC2=NC=CC=C2C=C1 89034 [0,1,0,0,0,0|1,0,0]=2 93 B15R2.1601 COC(=O)C1=CC2=NC=CC=C2N=C1 87409 [0,1,0,0,0,0|2,0,0]=3 94 B15R2.1601 COC(=O)C1=NC2=CC=CC=C2C=N1 W10783 [0,1,0,0,0,0|2,0,0]=3 95 B15R2.1601 COC(=O)C1=NC2=CC=CC=C2N=C1 25867 [0,1,0,0,0,0|2,0,0]=3 96 B15R2.1601 NNC(=S)C1=CC2=CC=CC=C2C=C1 W10980 [0,1,0,0,0,0|1,1,0]=3 97 B15R2.1601 N[C@@H](CO)C1=CC2=CC=CC=C2C=C1 Y10871 [0,1,0,0,0,0|1,0,1]=3 98 B15R2.1601 N[C@@H](CO)C1=CC2=CC=CC=C2C=C1 Y11234 [0,1,0,0,0,0|1,0,1]=3 99 B15R2.1601 N[C@@H](CO)C1=CC2=CC=CC=C2C=C1 Y12178 [0,1,0,0,0,0|1,0,1]=3 100 B15R2.1601 O=CC(=O)C1=CC2=CC=CC=C2C=C1 23347 [0,1,0,0,0,0|0,0,1]=2 101 B15R2.4441 CC(C)(C)C1=CC=C2N=CC=CC2=C1 T71218 [0,1,0,0,0,0|2,0,1]=4 102 B15R2.4441 O=S(=O)(Cl)C1=CC2=NC=CC=C2C=C1 85586 [0,1,0,0,0,0|3,0,0]=4 103 B15R2.7174 CC(=O)C1=CC=C2C=NC(Cl)=CC2=C1 79472 [0,1,0,0,0,0|1,0,0]=2 104 B15R2.7174 CC(=O)C1=CC=C2N=CC(Br)=CC2=C1 K10013 [0,1,0,0,0,0|1,0,0]=2 105 B15R2.7174 CC1=CC=C2C=CC(C(=O)O)=NC2=C1 71890 [0,1,0,0,0,0|2,0,0]=3 106 B15R2.7174 NC(=O)C1=CN=C2C=CC(Br)=CC2=C1 C72189 [0,1,0,0,0,0|2,0,0]=3 107 B15R2.7174 NC1=CC=C2C=CC(C(=O)O)=CC2=N1 D97531 [0,1,0,0,0,0|2,0,0]=3 108 B15R2.7174 NC1=CC=C2N=CC(C(=O)O)=CC2=C1 80385 [0,1,0,0,0,0|2,0,0]=3 109 B15R2.7174 NC1=CN=C2C=CC(C(=O)O)=CC2=C1 33245 [0,1,0,0,0,0|2,0,0]=3 110 B15R2.7174 NC1=CN=C2C=CC([N+](=O)[O-])=CC2=C1 33229 [0,1,0,0,0,0|3,0,0]=4 111 B15R2.7174 NC1=NC=C2C=CC(C(=O)O)=CC2=C1 68509 [0,1,0,0,0,0|2,0,0]=3 112 B15R2.7174 O=C(O)C1=CC2=CC(O)=CC=C2C=C1 W17822 [0,1,0,0,0,0|1,0,0]=2 113 B15R2.7174 O=C(O)C1=CC2=CC(O)=CC=C2N=C1 80315 [0,1,0,0,0,0|2,0,0]=3 114 B15R2.7174 O=C(O)C1=CC2=CC(O)=CN=C2C=C1 33294 [0,1,0,0,0,0|2,0,0]=3 115 B15R2.7174 O=C(O)C1=CC2=NC(O)=CC=C2C=C1 CS1524 [0,1,0,0,0,0|2,0,0]=3 116 B15R2.7174 O=C(O)C1=CC=C2C=CC(Br)=CC2=C1 C15879 [0,1,0,0,0,0|1,0,0]=2 117 B15R2.7174 O=C(O)C1=CC=C2C=CC(Br)=CC2=N1 27031 [0,1,0,0,0,0|2,0,0]=3 118 B15R2.7174 O=C(O)C1=CC=C2N=CC(Br)=CC2=C1 33290 [0,1,0,0,0,0|2,0,0]=3 119 B15R2.7174 O=C(O)C1=CN=C2C=CC(Br)=CC2=C1 69444 [0,1,0,0,0,0|2,0,0]=3 120 B15R2.7174 O=C(O)C1=NC=C2C=CC(Br)=CC2=C1 O11561 [0,1,0,0,0,0|2,0,0]=3 121 B15R2.7174 O=[N+]([O-])C1=CC=C2C=CC(Br)=NC2=C1 O10698 [0,1,0,0,0,0|3,0,0]=4 122 B15R2.7174 O=[N+]([O-])C1=CC=C2N=CC(Br)=CC2=C1 33225 [0,1,0,0,0,0|3,0,0]=4 123 B15R2.7180 CC(=O)C1=CC2=CC=C(N)C=C2C=C1 81652 [0,1,0,0,0,0|0,0,0]=1 124 B15R2.7180 CC(=O)C1=CC=C2C=C(Br)C=CC2=C1 11591 [0,1,0,0,0,0|0,0,0]=1 125 B15R2.7180 CC(=O)C1=CC=C2C=C(F)C=CC2=C1 D83927 [0,1,0,0,0,0|0,0,0]=1 126 B15R2.7180 CC(=O)C1=CN=C2C=C(Br)C=CC2=C1 K10054 [0,1,0,0,0,0|1,0,0]=2 127 B15R2.7180 CC1=CC=C2N=C(C(=O)O)C=CC2=C1 72196 [0,1,0,0,0,0|2,0,0]=3 128 B15R2.7180 CN(C)C1=CC=C2C=C(Br)C=CC2=C1 AC7990 [0,1,0,0,0,0|2,0,0]=3 129 B15R2.7180 NC(=O)C1=CC=C2C=C(Br)C=CC2=C1 AB10406 [0,1,0,0,0,0|1,0,0]=2 130 B15R2.7180 NC(=O)C1=CC=C2C=C(Br)C=NC2=C1 K10048 [0,1,0,0,0,0|2,0,0]=3 131 B15R2.7180 NC1=CC=C2C=C(C(=O)O)C=NC2=C1 80391 [0,1,0,0,0,0|2,0,0]=3 132 B15R2.7180 NC1=CC=C2C=C([N+](=O)[O-])C=CC2=C1 C15577 [0,1,0,0,0,0|2,0,0]=3 133 B15R2.7180 NC1=CN=C2C=C(C(=O)O)C=NC2=C1 K10129 [0,1,0,0,0,0|3,0,0]=4 134 B15R2.7180 NC1=CN=C2C=C([N+](=O)[O-])C=CC2=C1 33230 [0,1,0,0,0,0|3,0,0]=4 135 B15R2.7180 O=C(O)C1=CC2=CC=C(O)C=C2N=C1 80418 [0,1,0,0,0,0|2,0,0]=3 136 B15R2.7180 O=C(O)C1=CC2=CC=C(O)N=C2C=C1 K10089 [0,1,0,0,0,0|2,0,0]=3 137 B15R2.7180 O=C(O)C1=CC2=NC=C(O)C=C2C=C1 73670 [0,1,0,0,0,0|2,0,0]=3 138 B15R2.7180 O=C(O)C1=CC=C2C=C(Br)C=CC2=N1 54791 [0,1,0,0,0,0|2,0,0]=3 139 B15R2.7180 O=C(O)C1=CC=C2C=C(Br)C=NC2=C1 33234 [0,1,0,0,0,0|2,0,0]=3 140 B15R2.7180 O=C(O)C1=CC=C2C=C(Br)C=NC2=N1 D85357 [0,1,0,0,0,0|3,0,0]=4 141 B15R2.7180 O=C(O)C1=CC=C2C=C(Cl)C=CC2=N1 50648 [0,1,0,0,0,0|2,0,0]=3 142 B15R2.7180 O=C(O)C1=CC=C2C=C(F)C=CC2=C1 78117 [0,1,0,0,0,0|1,0,0]=2 143 B15R2.7180 O=C(O)C1=CC=C2C=C(F)C=CC2=N1 80317 [0,1,0,0,0,0|2,0,0]=3 144 B15R2.7180 O=C(O)C1=CC=C2N=C(Br)C=CC2=C1 K10090 [0,1,0,0,0,0|2,0,0]=3 145 B15R2.7180 O=C(O)C1=CC=C2N=C(Cl)C=CC2=C1 80404 [0,1,0,0,0,0|2,0,0]=3 146 B15R2.7180 O=C(O)C1=CN=C2C=C(Br)C=CC2=C1 69420 [0,1,0,0,0,0|2,0,0]=3 147 B15R2.7180 O=C(O)C1=CN=C2C=C(F)C=CC2=C1 69422 [0,1,0,0,0,0|2,0,0]=3 148 B15R2.7180 O=C(O)C1=NC2=CC=C(O)C=C2C=C1 72248 [0,1,0,0,0,0|2,0,0]=3 149 B15R2.7180 O=C(O)C1=NC=C2C=C(Br)C=CC2=C1 27728 [0,1,0,0,0,0|2,0,0]=3 150 B15R2.7180 O=C(O)C1=NC=C2C=C(Cl)C=CC2=C1 50661 [0,1,0,0,0,0|2,0,0]=3 151 B15R2.7180 O=C(O)C1=NC=C2C=C(Cl)C=CC2=N1 50645 [0,1,0,0,0,0|3,0,0]=4 152 B15R2.7180 O=C(O)C1=NN=C2C=C(Cl)C=CC2=C1 50660 [0,1,0,0,0,0|3,0,0]=4 153 B15R2.13598 NC(=O)C1=CC2=C(C=C1)C(=O)NC=N2 81226 [0,1,0,0,0,0|3,0,0]=4 154 B15R2.13598 NC1=C2C=CC(C(=O)O)=CC2=CC=N1 87794 [0,1,0,0,0,0|2,0,0]=3 155 B15R2.13598 NC1=C2C=CC([N+](=O)[O-])=CC2=CN=C1 73658 [0,1,0,0,0,0|3,0,0]=4 156 B15R2.13598 NC1=C2N=CC(C(=O)O)=CC2=CC=C1 80389 [0,1,0,0,0,0|2,0,0]=3 157 B15R2.13598 O=C(O)C1=CC2=C(C=C1)C(=O)C=CN2 C77278 [0,1,0,0,0,0|2,0,0]=3 158 B15R2.13598 O=C(O)C1=CC2=C(C=C1)C(=O)NC=C2 85202 [0,1,0,0,0,0|2,0,0]=3 159 B15R2.13598 O=C(O)C1=CC2=CC=CC(O)=C2N=C1 80419 [0,1,0,0,0,0|2,0,0]=3 160 B15R2.13598 O=C(O)C1=CC=C2C(=C1)C=CN=C2Cl 87798 [0,1,0,0,0,0|2,0,0]=3 161 B15R2.13598 O=C(O)C1=CC=C2C(Br)=CC=CC2=N1 27619 [0,1,0,0,0,0|2,0,0]=3 162 B15R2.13598 O=C(O)C1=CC=C2C(Cl)=CC=CC2=N1 88974 [0,1,0,0,0,0|2,0,0]=3 163 B15R2.13598 O=C(O)C1=CC=C2C(Cl)=CC=NC2=C1 67577 [0,1,0,0,0,0|2,0,0]=3 164 B15R2.13598 O=C(O)C1=CN=C2C(Cl)=CC=CC2=C1 69459 [0,1,0,0,0,0|2,0,0]=3 165 B15R2.13598 O=C(O)C1=CN=C2C(Cl)=CC=NC2=C1 K10099 [0,1,0,0,0,0|3,0,0]=4 166 B15R2.13598 O=C(O)C1=CN=C2C(F)=CC=CC2=C1 69457 [0,1,0,0,0,0|2,0,0]=3 167 B15R2.13598 O=[N+]([O-])C1=CC=C2C(Br)=CN=CC2=C1 K10267 [0,1,0,0,0,0|3,0,0]=4 168 B15R2.13598 O=[N+]([O-])C1=CC=C2C(Cl)=CC=NC2=C1 84264 [0,1,0,0,0,0|3,0,0]=4 169 B15R2.14951 CC1=CC(C(=O)O)=NC2=CC=CC=C12 71379 [0,1,0,0,0,0|2,0,0]=3 170 B15R2.14951 O=C(O)C1=CC(=O)C2=C(C=CC=C2)N1 C14645 [0,1,0,0,0,0|2,0,0]=3 171 B15R2.14951 O=C(O)C1=CC2=C(C=CC=C2)C(=O)N1 AC6743 [0,1,0,0,0,0|2,0,0]=3 172 B15R2.14951 O=C(O)C1=CC2=CC=CC=C2C(Br)=C1 93808 [0,1,0,0,0,0|1,0,0]=2 173 B15R2.14951 O=C(O)C1=CC2=CC=CN=C2C(Br)=C1 P16870 [0,1,0,0,0,0|2,0,0]=3 174 B15R2.14951 O=C(O)C1=CC2=CC=CN=C2C(F)=C1 K10188 [0,1,0,0,0,0|2,0,0]=3 175 B15R2.14951 O=C(O)C1=CC2=NC=CN=C2C(Br)=C1 C72511 [0,1,0,0,0,0|3,0,0]=4 176 B15R2.14951 O=C(O)C1=NC2=CC=CC=C2C(Br)=C1 C73945 [0,1,0,0,0,0|2,0,0]=3 177 B15R2.14951 O=[N+]([O-])C1=CC2=CC=CN=C2C(Br)=C1 84591 [0,1,0,0,0,0|3,0,0]=4 178 B15R2.61353 NC(=O)C1=CC2=C(C=C1)NC=NC2=O C72862 [0,1,0,0,0,0|3,0,0]=4 179 B15R2.61353 NC(=O)C1=CC=C2N=CC=C(Br)C2=C1 D80288 [0,1,0,0,0,0|2,0,0]=3 180 B15R2.61353 NC1=C2C=C(C(=O)O)C=CC2=NC=C1 80383 [0,1,0,0,0,0|2,0,0]=3 181 B15R2.61353 O=C(O)C1=CC2=C(C=CNC2=O)C=C1 D79743 [0,1,0,0,0,0|2,0,0]=3 182 B15R2.61353 O=C(O)C1=CC2=C(O)C=CC=C2N=C1 80318 [0,1,0,0,0,0|2,0,0]=3 183 B15R2.61353 O=C(O)C1=CC=C2C=CC=C(Cl)C2=N1 80169 [0,1,0,0,0,0|2,0,0]=3 184 B15R2.61353 O=C(O)C1=CC=C2C=NC=C(Br)C2=C1 P15167 [0,1,0,0,0,0|2,0,0]=3 185 B15R2.61353 O=C(O)C1=CC=C2N=CC=C(Cl)C2=C1 80127 [0,1,0,0,0,0|2,0,0]=3 186 B15R2.61353 O=C(O)C1=CN=C2C=CC=C(Br)C2=C1 69464 [0,1,0,0,0,0|2,0,0]=3 187 B15R2.61353 O=C(O)C1=CN=C2C=CC=C(Cl)C2=C1 80319 [0,1,0,0,0,0|2,0,0]=3 188 B15R2.61353 O=C(O)C1=CN=C2C=CC=C(F)C2=C1 80320 [0,1,0,0,0,0|2,0,0]=3 189 B15R2.61353 O=C1NC=CC2=C1C=C([N+](=O)[O-])C=C2 36414 [0,1,0,0,0,0|3,0,0]=4 190 B15R2.61353 O=[N+]([O-])C1=CC2=C(O)C=CN=C2C=C1 Y14688 [0,1,0,0,0,0|3,0,0]=4 191 B15R2.61353 O=[N+]([O-])C1=CC=C2C=CN=C(Cl)C2=C1 F15652 [0,1,0,0,0,0|3,0,0]=4 192 B15R2.61353 O=[N+]([O-])C1=CC=C2N=CC=C(Br)C2=C1 F20145 [0,1,0,0,0,0|3,0,0]=4 193 B15R2.61353 O=[N+]([O-])C1=CC=C2N=CC=C(Cl)C2=C1 Y10507 [0,1,0,0,0,0|3,0,0]=4 194 B13R1.74 C=CCOC1=CC=C(C(=O)O)C=C1 W13352 [0,0,1,0,0,0|2,0,1]=4 195 B13R2.72 CC(=O)C1=C2C=CC=CN2N=C1 F30968 [0,0,0,0,1,0|2,0,0]=3 196 B13R2.72 CC(=O)C1=CN=C2C=NC=CN12 C76500 [0,0,0,0,1,0|3,0,0]=4 197 B13R2.72 CC(=O)C1=CNC2=C1C=CN=C2 75040 [0,0,0,0,1,0|2,0,0]=3 198 B13R2.72 CC(=O)C1=CNC2=C1C=NC=C2 88177 [0,0,0,0,1,0|2,0,0]=3 199 B13R2.72 CC(=O)C1=CNC2=CC=CN=C21 CL3459 [0,0,0,0,1,0|2,0,0]=3 200 B13R2.72 CC(=O)C1=CNC2=NC=CN=C12 32836 [0,0,0,0,1,0|3,0,0]=4 201 B13R2.72 CC(=O)C1=NNC2=C1C=CC=C2 50300 [0,0,0,0,1,0|2,0,0]=3 202 B13R2.72 CC(=O)C1=NNC2=C1C=CC=N2 F17870 [0,0,0,0,1,0|3,0,0]=4 203 B13R2.72 CC(=O)N1C=CC2=C1C=CC=C2 62716 [0,0,0,0,1,0|1,0,0]=2 204 B13R2.72 CC(=O)N1N=CC2=C1C=NC=C2 F18121 [0,0,0,0,1,0|3,0,0]=4 205 B13R2.72 O=C(O)C1=C2C=NC=CN2C=C1 D80897 [0,0,0,0,1,0|3,0,0]=4 206 B13R2.72 O=C(O)C1=CNC2=C1C=CN=C2 69396 [0,0,0,0,1,0|3,0,0]=4 207 B13R2.72 O=C(O)C1=CNC2=C1C=NC=C2 26307 [0,0,0,0,1,0|3,0,0]=4 208 B13R2.72 O=C(O)C1=NC=C2C=CC=CN21 P18845 [0,0,0,0,1,0|3,0,0]=4 209 B13R2.72 O=[N+]([O-])C1=CNC2=C1C=CC=C2 O11037 [0,0,0,0,1,0|3,0,0]=4 210 B13R2.430 CC(=O)C1=CC2=C(C=C1)C=NN2 P11259 [0,0,0,0,1,0|2,0,0]=3 211 B13R2.430 CC(=O)C1=CC2=C(C=C1)CCO2 I10960 [0,0,0,0,1,0|1,0,2]=4 212 B13R2.430 CC(=O)C1=CC2=C(C=C1)OC=C2 73876 [0,0,0,0,1,0|1,0,0]=2 213 B13R2.430 CC(=O)C1=CC2=NC=CN2C=C1 P15887 [0,0,0,0,1,0|2,0,0]=3 214 B13R2.430 CC(=O)C1=CN2C=CN=C2C=C1 F15709 [0,0,0,0,1,0|2,0,0]=3 215 B13R2.430 CC(=O)C1=CN=C2NC=CC2=C1 37224 [0,0,0,0,1,0|2,0,0]=3 216 B13R2.430 CC(=O)C1=CN=C2NN=CC2=C1 79446 [0,0,0,0,1,0|3,0,0]=4 217 B13R2.430 CC(C)C1=CC2=C(C=C1)NC=C2 F17759 [0,0,0,0,1,0|2,0,1]=4 218 B13R2.430 C[C@H](N)C1=CC2=C(C=C1)NC=C2 71332 [0,0,0,0,1,0|2,0,1]=4 219 B13R2.430 NC(=O)C1=CC2=C(C=C1)C=NN2 C77074 [0,0,0,0,1,0|3,0,0]=4 220 B13R2.430 NC(=O)C1=CC2=C(C=C1)NC=N2 C71539 [0,0,0,0,1,0|3,0,0]=4 221 B13R2.430 O=C(O)C1=CC2=C(C=C1)OC=N2 25581 [0,0,0,0,1,0|3,0,0]=4 222 B13R2.430 O=C(O)C1=CC2=C(C=C1)SC=C2 F51397 [0,0,0,0,1,0|2,0,0]=3 223 B13R2.430 O=C(O)C1=CC2=C(C=CS2)N=C1 76799 [0,0,0,0,1,0|3,0,0]=4 224 B13R2.430 O=C(O)C1=CC2=CC=CN2C=N1 SC1421 [0,0,0,0,1,0|3,0,0]=4 225 B13R2.430 O=C(O)C1=CC2=CC=NN2C=C1 68019 [0,0,0,0,1,0|3,0,0]=4 226 B13R2.430 O=C(O)C1=CC2=CN=CN2C=C1 C73083 [0,0,0,0,1,0|3,0,0]=4 227 B13R2.430 O=C(O)C1=CN2C=CN=C2C=C1 81216 [0,0,0,0,1,0|3,0,0]=4 228 B13R2.430 O=C(O)C1=CN2C=NC=C2C=C1 26971 [0,0,0,0,1,0|3,0,0]=4 229 B13R2.430 O=C(O)C1=CN=C2C=CNC2=C1 P10766 [0,0,0,0,1,0|3,0,0]=4 230 B13R2.430 O=C(O)C1=CN=C2C=COC2=C1 S11662 [0,0,0,0,1,0|3,0,0]=4 231 B13R2.430 O=C(O)C1=NC2=C(C=C1)NC=C2 38388 [0,0,0,0,1,0|3,0,0]=4 232 B13R2.430 O=C(O)C1=NC=C2NC=CC2=C1 27107 [0,0,0,0,1,0|3,0,0]=4 233 B13R2.430 O=C(O)C1=NC=C2OC=CC2=C1 27620 [0,0,0,0,1,0|3,0,0]=4 234 B13R2.430 O=[N+]([O-])C1=CC2=C(C=C1)OC=C2 W12159 [0,0,0,0,1,0|3,0,0]=4 235 B13R2.435 CC(=O)C1=CN2C=CC=CC2=N1 72371 [0,0,0,0,1,0|2,0,0]=3 236 B13R2.435 CC(=O)C1=NC2=C(C=CC=C2)O1 25646 [0,0,0,0,1,0|2,0,0]=3 237 B13R2.435 CC(=O)C1CC2=C(C=CC=C2)C1 75402 [0,0,0,0,1,0|0,0,3]=4 238 B13R2.435 NC(=O)C1=CC2=C(C=CC=C2)N1 F53644 [0,0,0,0,1,0|2,0,0]=3 239 B13R2.435 NC(=O)C1=CC2=C(N=CC=C2)N1 P15923 [0,0,0,0,1,0|3,0,0]=4 240 B13R2.435 NC(=O)C1=NN2C=CC=CC2=C1 F52742 [0,0,0,0,1,0|3,0,0]=4 241 B13R2.435 NC(=S)C1=CC2=C(C=CC=C2)N1 D97587 [0,0,0,0,1,0|2,1,0]=4 242 B13R2.435 O=C(O)C1=CC2=C(C=CC=C2)C1 AC1335 [0,0,0,0,1,0|1,0,1]=3 243 B13R2.435 O=C(O)C1=CC2=C(C=CC=N2)S1 37347 [0,0,0,0,1,0|3,0,0]=4 244 B13R2.435 O=C(O)C1=CC2=C(C=CN=C2)S1 81378 [0,0,0,0,1,0|3,0,0]=4 245 B13R2.435 O=C(O)C1=CC2=C(C=NC=C2)O1 87399 [0,0,0,0,1,0|3,0,0]=4 246 B13R2.435 O=C(O)C1=CC2=C(C=NC=C2)S1 87593 [0,0,0,0,1,0|3,0,0]=4 247 B13R2.435 O=C(O)C1=CC2=CC=CN=C2S1 68599 [0,0,0,0,1,0|3,0,0]=4 248 B13R2.435 O=C(O)C1=CN2N=CC=CC2=C1 L10193 [0,0,0,0,1,0|3,0,0]=4 249 B13R2.435 O=C(O)C1=NC2=C(C=CC=C2)S1 25340 [0,0,0,0,1,0|3,0,0]=4 250 B13R2.435 O=C([O-])C1=NC2=C(C=CC=C2)O1 20910 [0,0,0,0,1,0|3,0,0]=4 251 B13R2.435 O=[N+]([O-])C1=CC2=C(C=CC=C2)O1 A12428 [0,0,0,0,1,0|3,0,0]=4 252 B15R2.1668 CC(=O)NC1=CC2=CC=CN=C2C=C1 F14237 [0,0,0,0,0,1|1,0,0]=2 253 B15R2.1668 C\[N+]([O-])=C/C1=CC2=CC=CC=C2C=C1 W19715 [0,0,0,0,0,1|1,0,1]=3 254 B15R2.1668 FC(F)OC1=CC2=CC=CC=C2C=C1 S10100 [0,0,0,0,0,1|2,0,1]=4 255 B15R2.1668 O=C(O)CC1=CC2=NC=CC=C2C=C1 D79230 [0,0,0,0,0,1|2,0,0]=3 256 B12R1.113 C=CCC1=CC=C(C(=O)O)C=C1 D93345 [1,0,1,0,0,0|1,0,1]=4 257 B12R1.279 C=CCC1=CC=CC(C(=O)O)=C1 D93325 [1,0,1,0,0,0|1,0,1]=4 258 B12R2.24 BrC1=CC2=NC=CC=C2C=C1 BL002815 [2,0,0,0,0,0|2,0,0]=4 259 B12R2.24 CC1=CC=C2C=NN=CC2=C1 T72939 [2,0,0,0,0,0|2,0,0]=4 260 B12R2.24 ClC1=CC2=CN=CC=C2C=C1 24371 [2,0,0,0,0,0|2,0,0]=4 261 B12R2.24 FC1=CC2=CC=CC=C2N=C1 F30311 [2,0,0,0,0,0|2,0,0]=4 262 B12R2.24 FC1=CC2=CN=CC=C2C=C1 90642 [2,0,0,0,0,0|2,0,0]=4 263 B12R2.24 FC1=NC2=CC=CC=C2C=C1 H10138 [2,0,0,0,0,0|2,0,0]=4 264 B12R2.24 IC1=CC2=CC=CC=C2N=C1 AB9519 [2,0,0,0,0,0|2,0,0]=4 265 B12R2.24 IC1=NC2=CC=CC=C2C=C1 71122 [2,0,0,0,0,0|2,0,0]=4 266 B12R2.24 NC1=CC=C2C=CC=NC2=C1 32470 [2,0,0,0,0,0|2,0,0]=4 267 B12R2.24 NC1=CC=C2C=CN=CC2=C1 24616 [2,0,0,0,0,0|2,0,0]=4 268 B12R2.24 O=C1C=C2C=CC=CC2=NN1 O11709 [2,0,0,0,0,0|2,0,0]=4 269 B12R2.24 O=C1C=CC2=CC=CN=C2N1 P11962 [2,0,0,0,0,0|2,0,0]=4 270 B12R2.24 SC1=CC2=CC=CC=C2N=C1 D83175 [2,0,0,0,0,0|1,1,0]=4 271 B12R2.24 [O-]C1=CC2=CC=CC=C2C=C1 A12912 [2,0,0,0,0,0|0,0,1]=3 272 B14R1.756 COC(=O)C(=O)\C=C\C1=CC=CC=C1 S11384 [0,1,1,0,0,0|1,0,0]=3 273 B14R1.756 COC(=O)[C@@H](N)\C=C\C1=CC=CC=C1 59851 [0,1,1,0,0,0|1,0,1]=4 274 B14R1.43 C=CC1=C(C(=O)O)C=CC(C(=O)O)=C1 C74062 [0,1,1,0,0,0|2,0,0]=4 275 B14R2.92 BrCC1=C(Br)C2=CC=CC=C2C=C1 70736 [1,1,0,0,0,0|1,0,1]=4 276 B14R2.92 COC1=C(Br)C2=CC=CN=C2C=C1 95712 [1,1,0,0,0,0|2,0,0]=4 277 B14R2.92 COC1=C(Br)C2=NC=CC=C2C=C1 72493 [1,1,0,0,0,0|2,0,0]=4 278 B14R2.92 COC1=C(N)C2=CC=CN=C2C=C1 K10154 [1,1,0,0,0,0|2,0,0]=4 279 B14R2.92 COC1=C(N)C2=NC=CC=C2C=C1 A50073 [1,1,0,0,0,0|2,0,0]=4 280 B14R2.92 N#CC1=C(N)C2=CC=CC=C2C=C1 F11587 [1,1,0,0,0,0|1,0,1]=4 281 B14R2.92 NC1=C(C=O)C=CC2=CC=CC=C21 D85347 [1,1,0,0,0,0|0,0,0]=2 282 B14R2.92 NC1=C(C=O)C=CC2=CC=CN=C21 F16248 [1,1,0,0,0,0|1,0,0]=3 283 B14R2.92 O=CC1=C(Cl)C2=CC=CC=C2N=C1 D71980 [1,1,0,0,0,0|1,0,0]=3 284 B14R2.92 O=CC1=C(O)C2=CC=CC=C2C=C1 W17445 [1,1,0,0,0,0|0,0,0]=2 285 B14R2.112 BrCCC1=CC2=CC=CC=C2C=C1 W17006 [1,1,0,0,0,0|0,0,1]=3 286 B14R2.112 C=CCC1=NC2=CC=CC=C2C=C1 D93767 [1,1,0,0,0,0|1,0,1]=4 287 B14R2.112 CNCC1=CC=C2N=CC=CC2=C1 29914 [1,1,0,0,0,0|1,0,1]=4 288 B14R2.112 ClCCC1=CC2=CC=CC=C2N=C1 D80777 [1,1,0,0,0,0|1,0,1]=4 289 B14R2.112 NCCC1=NC2=CC=CC=C2C=C1 83238 [1,1,0,0,0,0|1,0,1]=4 290 B14R2.134 COC1=CC2=CC(C)=CC=C2C=C1 N14596 [1,1,0,0,0,0|1,0,0]=3 291 B14R2.134 COC1=CC2=CC(N)=CN=C2C=C1 80367 [1,1,0,0,0,0|2,0,0]=4 292 B14R2.134 COC1=CC2=NC(C)=CC=C2C=C1 F14750 [1,1,0,0,0,0|2,0,0]=4 293 B14R2.134 COC1=CC=C2C=CC(Br)=CC2=C1 W18403 [1,1,0,0,0,0|1,0,0]=3 294 B14R2.134 COC1=CC=C2C=CC(Cl)=CC2=C1 N14595 [1,1,0,0,0,0|1,0,0]=3 295 B14R2.134 COC1=CC=C2C=CC(Cl)=NC2=C1 P16665 [1,1,0,0,0,0|2,0,0]=4 296 B14R2.134 COC1=CC=C2N=CC(Br)=CC2=C1 80422 [1,1,0,0,0,0|2,0,0]=4 297 B14R2.134 COC1=CC=C2N=CC(F)=CC2=C1 69135 [1,1,0,0,0,0|2,0,0]=4 298 B14R2.134 COC1=NC2=CC(N)=CC=C2C=C1 D71004 [1,1,0,0,0,0|2,0,0]=4 299 B14R2.134 N#CC1=CC=C2C=CC(O)=CC2=C1 C14549 [1,1,0,0,0,0|1,0,1]=4 300 B14R2.134 O=CC1=CC=C2C=CC(Cl)=CC2=N1 71569 [1,1,0,0,0,0|1,0,0]=3 301 B14R2.134 O=CC1=CC=C2C=CC(F)=CC2=N1 AT13140 [1,1,0,0,0,0|1,0,0]=3 302 B14R2.134 O=CC1=CC=C2C=NC(Cl)=CC2=C1 78614 [1,1,0,0,0,0|1,0,0]=3 303 B14R2.134 O=CC1=CN=C2C=CC(Br)=CC2=C1 I11231 [1,1,0,0,0,0|1,0,0]=3 304 B14R2.134 O=CC1=CN=C2C=CC(Cl)=CC2=C1 C72467 [1,1,0,0,0,0|1,0,0]=3 305 B14R2.142 CCC1=CC=C2C=CC=C(O)C2=C1 Y11362 [1,1,0,0,0,0|0,0,1]=3 306 B14R2.142 COC1=CC2=C(C)C=CN=C2C=C1 W18754 [1,1,0,0,0,0|2,0,0]=4 307 B14R2.142 COC1=CC2=C(O)C=CC=C2C=C1 62544 [1,1,0,0,0,0|1,0,0]=3 308 B14R2.142 COC1=CC=C2C=CC=C(Br)C2=C1 N14593 [1,1,0,0,0,0|1,0,0]=3 309 B14R2.142 COC1=CC=C2C=CC=C(Cl)C2=N1 W17081 [1,1,0,0,0,0|2,0,0]=4 310 B14R2.142 COC1=CC=C2C=CN=C(I)C2=C1 79282 [1,1,0,0,0,0|2,0,0]=4 311 B14R2.142 COC1=CC=C2N=CC=C(Br)C2=C1 C15797 [1,1,0,0,0,0|2,0,0]=4 312 B14R2.142 COC1=NC2=C(O)C=CC=C2C=C1 75570 [1,1,0,0,0,0|2,0,0]=4 313 B14R2.142 COC1=NC=C2C=CC=C(Br)C2=C1 D79780 [1,1,0,0,0,0|2,0,0]=4 314 B14R2.142 O=CC1=CC=C2C=CC=C(Br)C2=N1 80199 [1,1,0,0,0,0|1,0,0]=3 315 B14R2.142 O=CC1=CC=C2C=CC=C(Cl)C2=N1 80187 [1,1,0,0,0,0|1,0,0]=3 316 B14R2.142 O=CC1=CC=C2C=CC=C(F)C2=N1 80264 [1,1,0,0,0,0|1,0,0]=3 317 B14R2.142 O=CC1=CC=C2C=CN=C(Cl)C2=C1 58058 [1,1,0,0,0,0|1,0,0]=3 318 B14R2.1019 COC1=CC2=CC=CC=C2C(Br)=C1 N11775 [1,1,0,0,0,0|1,0,0]=3 319 B14R2.1019 COC1=CC2=CC=CN=C2C(Cl)=C1 68225 [1,1,0,0,0,0|2,0,0]=4 320 B14R2.1019 COC1=CC2=NC=CC=C2C(Br)=C1 O11386 [1,1,0,0,0,0|2,0,0]=4 321 B14R2.1019 COC1=NC2=CC=CC=C2C(Cl)=C1 F17332 [1,1,0,0,0,0|2,0,0]=4 322 B14R2.1019 O=CC1=CC2=CC=CC=C2C(Br)=C1 FD10651 [1,1,0,0,0,0|0,0,0]=2 323 B14R2.1128 COC1=CC2=CC=CC=C2C=C1Br E10143 [1,1,0,0,0,0|1,0,0]=3 324 B14R2.1128 COC1=CC2=CC=CN=C2C=C1C W10697 [1,1,0,0,0,0|2,0,0]=4 325 B14R2.1128 COC1=CC2=CN=CC=C2C=C1F 81069 [1,1,0,0,0,0|2,0,0]=4 326 B14R2.1128 COC1=CC2=CN=CC=C2C=C1I 97843 [1,1,0,0,0,0|2,0,0]=4 327 B14R2.1128 COC1=CC2=NC=CC=C2C=C1Br F30699 [1,1,0,0,0,0|2,0,0]=4 328 B14R2.1128 COC1=CC2=NC=CC=C2C=C1N F30700 [1,1,0,0,0,0|2,0,0]=4 329 B14R2.1128 N#CC1=CC2=CC=CC=C2C=C1O AC6293 [1,1,0,0,0,0|1,0,1]=4 330 B14R2.1128 O=CC1=CC2=CC=CC=C2C=C1F E70294 [1,1,0,0,0,0|0,0,0]=2 331 B14R2.1128 O=CC1=CC2=CC=CC=C2C=C1O F16157 [1,1,0,0,0,0|0,0,0]=2 332 B14R2.1128 O=CC1=CC2=CC=CN=C2C=C1F 27721 [1,1,0,0,0,0|1,0,0]=3 333 B14R2.1128 O=CC1=NC2=CC=CC=C2C=C1Cl F16392 [1,1,0,0,0,0|1,0,0]=3 334 B14R2.1801 COC1=CC2=C(C=C1)C(=O)C=CO2 56993 [1,1,0,0,0,0|2,0,0]=4 335 B14R2.1801 COC1=CC2=CC=NC(N)=C2C=C1 CL1045 [1,1,0,0,0,0|2,0,0]=4 336 B14R2.1801 COC1=CC2=NC=CC(C)=C2C=C1 C73479 [1,1,0,0,0,0|2,0,0]=4 337 B14R2.1801 COC1=CC=C2C(Br)=CC=NC2=C1 CS1278 [1,1,0,0,0,0|2,0,0]=4 338 B14R2.1801 N#CC1=CC=C2C(Br)=CC=CC2=C1 53845 [1,1,0,0,0,0|1,0,1]=4 339 B14R2.2332 C=CC1=CC=C2C=C(O)C=CC2=C1 C72481 [1,1,0,0,0,0|0,0,1]=3 340 B14R2.2332 CC1=CC=C2C=C(C=O)C=CC2=N1 27234 [1,1,0,0,0,0|1,0,0]=3 341 B14R2.2332 CC1=CC=C2N=C(C=O)C=CC2=C1 71624 [1,1,0,0,0,0|1,0,0]=3 342 B14R2.2332 CCC1=CC=C2C=C(O)C=CC2=C1 C10686 [1,1,0,0,0,0|0,0,1]=3 343 B14R2.2332 COC1=CC2=C(C=C1)NC(=O)C=C2 W10314 [1,1,0,0,0,0|2,0,0]=4 344 B14R2.2332 COC1=CC2=NC=C(N)C=C2C=C1 80439 [1,1,0,0,0,0|2,0,0]=4 345 B14R2.2332 COC1=CC=C2C=C(Br)C=NC2=C1 F11731 [1,1,0,0,0,0|2,0,0]=4 346 B14R2.2332 COC1=CC=C2C=C(Cl)N=CC2=C1 96203 [1,1,0,0,0,0|2,0,0]=4 347 B14R2.2332 COC1=CC=C2N=C(Br)C=CC2=C1 83962 [1,1,0,0,0,0|2,0,0]=4 348 B14R2.2332 COC1=CN=C2C=C(Br)C=CC2=C1 O11634 [1,1,0,0,0,0|2,0,0]=4 349 B14R2.2332 N#CC1=CC=C2C=C(Br)C=CC2=C1 AB6429 [1,1,0,0,0,0|1,0,1]=4 350 B14R2.2332 O=CC1=CC=C2C=C(Br)C=CC2=N1 80285 [1,1,0,0,0,0|1,0,0]=3 351 B14R2.2332 O=CC1=CC=C2C=C(Br)C=NC2=C1 27956 [1,1,0,0,0,0|1,0,0]=3 352 B14R2.2332 O=CC1=CC=C2C=C(Cl)N=CC2=C1 78615 [1,1,0,0,0,0|1,0,0]=3 353 B14R2.2332 O=CC1=CC=C2N=C(Cl)C=CC2=C1 N13262 [1,1,0,0,0,0|1,0,0]=3 354 B14R2.2332 O=CC1=CN=C2C=C(Br)C=CC2=C1 K10053 [1,1,0,0,0,0|1,0,0]=3 355 B14R2.2332 OCC1=CC=C2C=C(Br)C=CC2=C1 F10523 [1,1,0,0,0,0|0,0,2]=4 356 B14R2.95 COC(=O)C1=C2C=CC=CC2=CN1 F30575 [0,1,0,0,1,0|1,0,0]=3 357 B14R2.95 COC(=O)C1=C2C=CC=CN2C=C1 F14132 [0,1,0,0,1,0|1,0,0]=3 358 B14R2.95 COC(=O)C1=C2C=CC=CN2C=N1 P11786 [0,1,0,0,1,0|2,0,0]=4 359 B14R2.95 COC(=O)C1=CNC2=C1C=NC=C2 74801 [0,1,0,0,1,0|2,0,0]=4 360 B14R2.95 COC(=O)C1=CSC2=C1C=CN=C2 D79811 [0,1,0,0,1,0|2,0,0]=4 361 B14R2.95 N#CC(=O)C1=CNC2=C1C=CC=C2 A12200 [0,1,0,0,1,0|1,0,1]=4 362 B14R2.95 O=C(CBr)C1=COC2=C1C=CC=C2 30170 [0,1,0,0,1,0|1,0,0]=3 363 B14R2.95 O=C(CBr)C1=CSC2=C1C=CC=C2 25593 [0,1,0,0,1,0|1,0,0]=3 364 B14R2.286 CS(=O)(=O)C1=CNC2=C1C=CC=C2 P16044 [0,1,0,0,1,0|2,0,0]=4 365 B14R2.300 CC(=O)N1C=CC2=C1C=CC(N)=C2 AC1234 [0,1,0,0,1,0|1,0,0]=3 366 B14R2.300 CC(=O)N1N=CC2=C1C=CC(O)=C2 I11008 [0,1,0,0,1,0|2,0,0]=4 367 B14R2.300 NC1=CC2=C(C=C1)C(C(=O)O)=CN2 CL3471 [0,1,0,0,1,0|2,0,0]=4 368 B14R2.300 O=C(O)C1=CNC2=C1C=CC(F)=C2 33872 [0,1,0,0,1,0|2,0,0]=4 369 B14R2.300 O=C(O)C1=COC2=C1C=CC(F)=C2 Y13506 [0,1,0,0,1,0|2,0,0]=4 370 B14R2.300 O=C(O)C1=COC2=C1C=CC(O)=C2 Y13505 [0,1,0,0,1,0|2,0,0]=4 371 B14R2.642 CC(=O)C1=C(C)N=C2C=CC=CN21 24912 [0,1,0,0,1,0|2,0,0]=4 372 B14R2.5816 CC(=O)C1=CNC2=C1C=C(Cl)C=C2 35116 [0,1,0,0,1,0|1,0,0]=3 373 B14R2.5816 CC(=O)C1=NNC2=C1C=C(Br)C=C2 F17877 [0,1,0,0,1,0|2,0,0]=4 374 B14R2.5816 NC1=CC2=C(C=C1)NC=C2C(=O)O Y14721 [0,1,0,0,1,0|2,0,0]=4 375 B14R2.5816 O=C(O)C1=CNC2=C1C=C(O)C=C2 O11444 [0,1,0,0,1,0|2,0,0]=4 376 B14R2.5816 O=C(O)C1=CSC2=C1C=C(Br)C=C2 F30058 [0,1,0,0,1,0|2,0,0]=4 377 B14R2.8032 CC(=O)C1=CNC2=C(Br)C=CC=C12 95759 [0,1,0,0,1,0|1,0,0]=3 378 B14R2.8032 CC(=O)N1N=CC2=C(Br)C=CC=C21 31453 [0,1,0,0,1,0|2,0,0]=4 379 B14R2.8032 O=C(O)C1=CNC2=C(Br)C=CC=C12 63741 [0,1,0,0,1,0|2,0,0]=4 380 B14R2.8032 O=C(O)C1=CNC2=C(F)C=CC=C12 F15642 [0,1,0,0,1,0|2,0,0]=4 381 B14R2.8032 O=C(O)C1=CNC2=C1C=CC=C2O P19114 [0,1,0,0,1,0|2,0,0]=4 382 B14R2.8053 CC(=O)C1=CNC2=CC=CC(I)=C21 AB1015 [0,1,0,0,1,0|1,0,0]=3 383 B14R2.8053 O=C(O)C1=CNC2=CC=CC(F)=C21 33852 [0,1,0,0,1,0|2,0,0]=4 384 B14R2.25733 CC(=O)C1=CN(C)C2=C1C=CC=C2 W17298 [0,1,0,0,1,0|1,0,0]=3 385 B14R2.601 CC(=O)C1=CC2=C(C=C1)N=C(Cl)S2 C75896 [0,1,0,0,1,0|2,0,0]=4 386 B14R2.601 CC(=O)C1=CC2=C(C=C1)NC(=O)C2 H10574 [0,1,0,0,1,0|1,0,1]=4 387 B14R2.601 CC(=O)C1=CC2=CN(C)N=C2C=C1 P11261 [0,1,0,0,1,0|2,0,0]=4 388 B14R2.601 CC(=O)C1=CC2=NN(C)C=C2C=C1 24154 [0,1,0,0,1,0|2,0,0]=4 389 B14R2.601 CC1=CC2=C(C=C(C(=O)O)C=C2)N1 I11052 [0,1,0,0,1,0|2,0,0]=4 390 B14R2.601 O=C(O)C1=CC2=C(C=C1)C=C(Br)N2 D80015 [0,1,0,0,1,0|2,0,0]=4 391 B14R2.601 O=C(O)C1=CC2=C(C=C1)OC(Cl)=C2 D85341 [0,1,0,0,1,0|2,0,0]=4 392 B14R2.624 CC1=C(C(=O)O)C=C2C=CNC2=C1 79353 [0,1,0,0,1,0|2,0,0]=4 393 B14R2.624 O=C(O)C1=C(Cl)C=C2C=CNC2=C1 P11949 [0,1,0,0,1,0|2,0,0]=4 394 B14R2.624 O=C(O)C1=C(F)C=C2C=CNC2=C1 I11067 [0,1,0,0,1,0|2,0,0]=4 395 B14R2.624 O=C(O)C1=C(F)C=C2NC=CC2=C1 W17101 [0,1,0,0,1,0|2,0,0]=4 396 B14R2.966 COC(=O)C1=CC2=C(C=C1)N=CO2 31916 [0,1,0,0,1,0|2,0,0]=4 397 B14R2.966 COC(=O)C1=CC2=C(C=C1)N=CS2 C76362 [0,1,0,0,1,0|2,0,0]=4 398 B14R2.966 COC(=O)C1=CC2=C(C=C1)OC=N2 W18095 [0,1,0,0,1,0|2,0,0]=4 399 B14R2.966 COC(=O)C1=CC2=C(C=C1)SC=N2 F14217 [0,1,0,0,1,0|2,0,0]=4 400 B14R2.966 COC(=O)C1=CC2=C(C=CO2)C=C1 68028 [0,1,0,0,1,0|1,0,0]=3 401 B14R2.966 COC(=O)C1=CC2=C(C=CS2)C=C1 F18424 [0,1,0,0,1,0|1,0,0]=3 402 B14R2.966 COC(=O)C1=CC2=C(C=N1)SC=C2 P21010 [0,1,0,0,1,0|2,0,0]=4 403 B14R2.966 COC(=O)C1=CC2=CC=NN2C=C1 79495 [0,1,0,0,1,0|2,0,0]=4 404 B14R2.966 COC(=O)C1=CN2C=NC=C2C=C1 D70694 [0,1,0,0,1,0|2,0,0]=4 405 B14R2.966 COC(=O)C1=CN=C2C=CNC2=C1 38465 [0,1,0,0,1,0|2,0,0]=4 406 B14R2.966 COC(=O)C1=NC2=C(C=C1)NC=C2 52590 [0,1,0,0,1,0|2,0,0]=4 407 B14R2.966 COC(=O)C1=NC2=C(C=C1)OC=C2 96803 [0,1,0,0,1,0|2,0,0]=4 408 B14R2.966 COC(=O)C1=NC2=C(C=CN2)C=C1 68163 [0,1,0,0,1,0|2,0,0]=4 409 B14R2.966 COC(=O)C1=NC=C2C=CNC2=C1 38036 [0,1,0,0,1,0|2,0,0]=4 410 B14R2.966 NNC(=O)C1=CC2=C(C=C1)NC=C2 F18166 [0,1,0,0,1,0|2,0,0]=4 411 B14R2.966 NNC(=O)C1=CC2=C(C=CN2)C=C1 F17946 [0,1,0,0,1,0|2,0,0]=4 412 B14R2.966 O=C(CBr)C1=CC2=C(C=C1)OC=C2 30233 [0,1,0,0,1,0|1,0,0]=3 413 B14R2.3125 CS(=O)(=O)C1=CC2=C(C=C1)NC=C2 89389 [0,1,0,0,1,0|2,0,0]=4 414 B14R2.5719 CC(=O)C1=CC2=C(C=C1)N(C)N=C2 78500 [0,1,0,0,1,0|2,0,0]=4 415 B14R2.5719 CC1=CNC2=C1C=CC(C(=O)O)=C2 80118 [0,1,0,0,1,0|2,0,0]=4 416 B14R2.5998 O=C(O)C1=C(F)C2=C(C=C1)NC=C2 F13711 [0,1,0,0,1,0|2,0,0]=4 417 B14R2.5998 O=C(O)C1=C(F)C2=C(C=CN2)C=C1 76410 [0,1,0,0,1,0|2,0,0]=4 418 B14R2.5998 O=C(O)C1=C(O)C2=C(C=C1)OC=C2 W11088 [0,1,0,0,1,0|2,0,0]=4 419 B14R2.8824 CC1=C2NC=CC2=CC(C(=O)O)=C1 72365 [0,1,0,0,1,0|2,0,0]=4 420 B14R2.8824 O=C(O)C1=CC(Br)=C2C=CNC2=C1 86992 [0,1,0,0,1,0|2,0,0]=4 421 B14R2.8824 O=C(O)C1=CC(Br)=C2OC=CC2=C1 P17986 [0,1,0,0,1,0|2,0,0]=4 422 B14R2.8824 O=C(O)C1=CC(Cl)=C2C=CNC2=C1 80370 [0,1,0,0,1,0|2,0,0]=4 423 B14R2.24358 CC(=O)C1=CC2=C(C=C1)C=NN2C D82501 [0,1,0,0,1,0|2,0,0]=4 424 B14R2.24358 CC(=O)C1=CC2=C(C=C1)CCC2=O O11526 [0,1,0,0,1,0|0,0,2]=4 425 B14R2.24358 CC1=CNC2=C1C=C(C(=O)O)C=C2 72086 [0,1,0,0,1,0|2,0,0]=4 426 B14R2.450 NC1=C(C(=O)O)SC2=C1C=CC=C2 D96951 [0,1,0,0,1,0|2,0,0]=4 427 B14R2.450 O=C(O)C1=C(Cl)C2=C(C=CC=C2)O1 C76764 [0,1,0,0,1,0|2,0,0]=4 428 B14R2.972 COC(=O)C1=CC2=C(C=CC=N2)N1 69397 [0,1,0,0,1,0|2,0,0]=4 429 B14R2.972 COC(=O)C1=CC2=C(C=CC=N2)S1 P11324 [0,1,0,0,1,0|2,0,0]=4 430 B14R2.972 COC(=O)C1=CN2C=CC=CC2=C1 55316 [0,1,0,0,1,0|1,0,0]=3 431 B14R2.972 COC(=O)C1=CN2N=CC=CC2=C1 L10158 [0,1,0,0,1,0|2,0,0]=4 432 B14R2.972 COC(=O)C1=NC2=C(C=CC=C2)N1 Y10077 [0,1,0,0,1,0|2,0,0]=4 433 B14R2.4529 CC(=O)C1=NC2=C(C=C(Br)C=C2)N1 F18230 [0,1,0,0,1,0|2,0,0]=4 434 B14R2.4529 CC1=CC2=C(C=C1)C=C(C(=O)O)S2 36036 [0,1,0,0,1,0|2,0,0]=4 435 B14R2.4529 NC(=O)C1=CC2=C(C=CC(Br)=C2)N1 W18188 [0,1,0,0,1,0|2,0,0]=4 436 B14R2.4529 NC1=CC2=C(C=C1)NC(C(=O)O)=C2 33854 [0,1,0,0,1,0|2,0,0]=4 437 B14R2.4529 NC1=CC2=C(C=C1)OC(C(=O)O)=C2 C15800 [0,1,0,0,1,0|2,0,0]=4 438 B14R2.4529 O=C(O)C1=CC2=C(C=C(Br)C=C2)O1 87196 [0,1,0,0,1,0|2,0,0]=4 439 B14R2.4529 O=C(O)C1=CC2=C(C=C(Cl)C=C2)O1 66237 [0,1,0,0,1,0|2,0,0]=4 440 B14R2.4529 O=C(O)C1=CC2=C(C=C(F)C=C2)O1 O11593 [0,1,0,0,1,0|2,0,0]=4 441 B14R2.4529 O=C(O)C1=CC2=C(C=C(O)C=C2)N1 62484 [0,1,0,0,1,0|2,0,0]=4 442 B14R2.4529 O=C(O)C1=CC2=C(C=C(O)C=C2)O1 AC2155 [0,1,0,0,1,0|2,0,0]=4 443 B14R2.4529 O=C(O)C1=CC2=C(C=C(O)C=C2)S1 12913 [0,1,0,0,1,0|2,0,0]=4 444 B14R2.4529 O=C(O)C1=CC2=C(C=CC(F)=C2)O1 W10186 [0,1,0,0,1,0|2,0,0]=4 445 B14R2.4529 O=C(O)C1=CC2=C(C=CC(O)=C2)N1 82246 [0,1,0,0,1,0|2,0,0]=4 446 B14R2.4529 O=C(O)C1=CC2=C(C=CC(O)=C2)O1 Y11630 [0,1,0,0,1,0|2,0,0]=4 447 B14R2.4529 O=C(O)C1=CN2C=C(Br)C=CC2=C1 55174 [0,1,0,0,1,0|2,0,0]=4 448 B14R2.7969 CC(=O)C1=CC2=C(O1)C(O)=CC=C2 D73244 [0,1,0,0,1,0|1,0,0]=3 449 B14R2.7969 CC1=CC=CC2=C1C=C(C(=O)O)N2 25669 [0,1,0,0,1,0|2,0,0]=4 450 B14R2.7969 CC1=CC=CC2=C1C=C(C(=O)O)S2 C73325 [0,1,0,0,1,0|2,0,0]=4 451 B14R2.7969 CC1=CC=CC2=C1NC(C(=O)O)=C2 74917 [0,1,0,0,1,0|2,0,0]=4 452 B14R2.7969 NC1=CC=CC2=C1C=C(C(=O)O)S2 D96953 [0,1,0,0,1,0|2,0,0]=4 453 B14R2.7969 O=C(O)C1=CC2=C(C=CC=C2F)S1 F13713 [0,1,0,0,1,0|2,0,0]=4 454 B14R2.7969 O=C(O)C1=CC2=C(N1)C(O)=CC=C2 48732 [0,1,0,0,1,0|2,0,0]=4 455 B14R2.7969 O=C(O)C1=CC2=CC=CC(F)=C2S1 F13950 [0,1,0,0,1,0|2,0,0]=4 456 B16R2.3989 CC(=O)NC1=CC2=C(C=CC=C2)OC1=O F17155 [0,1,0,0,0,1|1,0,0]=3 457 B16R2.3989 O=C(O)CC1=CC2=CC=CN=C2C=C1F 33656 [0,1,0,0,0,1|2,0,0]=4 458 B16R2.5347 COC(=O)CC1=CC2=CC=CN=C2C=C1 87415 [0,1,0,0,0,1|1,0,0]=3 459 B16R2.5347 COC(=O)CC1=CC2=NC=CN=C2C=C1 33752 [0,1,0,0,0,1|2,0,0]=4 460 B16R2.5347 COC(=O)CC1=NC2=CC=CN=C2C=C1 37486 [0,1,0,0,0,1|2,0,0]=4 461 B16R2.5347 N\C(CC1=CC2=CC=CC=C2C=C1)=N/O W10720 [0,1,0,0,0,1|1,0,1]=4 462 B16R2.6284 N[C@@H](C(=O)O)C1=CC2=CC=CC=C2C=C1 52146 [0,1,0,0,0,1|1,0,0]=3 463 B16R2.6284 N[C@@H](C(=O)O)C1=CC2=CC=CC=C2C=C1 Y10870 [0,1,0,0,0,1|1,0,0]=3 464 B16R2.6284 N[C@@H](C(=O)O)C1=CC2=CC=CC=C2C=C1 Y11454 [0,1,0,0,0,1|1,0,0]=3 465 B16R2.11975 CC(=O)OC1=CC=C2N=CC(Br)=CC2=C1 78875 [0,1,0,0,0,1|1,0,0]=3 466 B16R2.11975 O=C(O)CC1=CC=C2N=CC(Br)=CC2=C1 F12155 [0,1,0,0,0,1|2,0,0]=4 467 B16R2.11988 CC(=O)NC1=CC=C2C=C(Br)C=CC2=C1 AB22190 [0,1,0,0,0,1|0,0,0]=2 468 B16R2.82802 CC(C)(N)CC1=CC2=CC=CC=C2C=C1 72632 [0,1,0,0,0,1|1,0,1]=4 469 B16R2.82802 CC(C)(N)CC1=CC2=CC=CC=C2C=C1 O10828 [0,1,0,0,0,1|1,0,1]=4 470 B16R2.83538 O=C(O)CN1C=CC2=C(C=CC=C2)C1=O C75761 [0,1,0,0,0,1|2,0,0]=4 471 B16R2.1229 COC(=O)C1=C(C)C2=NC=CC=C2C=C1 C71130 [0,2,0,0,0,0|1,0,0]=3 472 B16R2.12044 CC1=CC=C2N=CC(C(=O)O)=C(O)C2=C1 C11330 [0,2,0,0,0,0|2,0,0]=4 473 B16R2.12044 O=C(O)C1=CNC2=C(C=C(I)C=C2)C1=O AB7320 [0,2,0,0,0,0|2,0,0]=4 474 B16R2.23331 CC(=O)C1=C(O)C2=CC=CC=C2C(Cl)=C1 AB1006 [0,2,0,0,0,0|0,0,0]=2 475 B16R2.23331 NC1=C([N+](=O)[O-])C=C(Br)C2=CC=CC=C21 O11174 [0,2,0,0,0,0|2,0,0]=4 476 B16R2.23372 O=C(O)C1=C(F)C2=CC=CN=C2C=C1F 65964 [0,2,0,0,0,0|2,0,0]=4 477 B16R2.133456 O=C(O)C1=C(O)C2=CC=C(O)C=C2C=C1 N11816 [0,2,0,0,0,0|1,0,0]=3 478 B16R2.133456 O=C(O)C1=CN=C2C=C(Br)C=CC2=C1O 34900 [0,2,0,0,0,0|2,0,0]=4 479 B16R2.1612 COC1=NC2=CC=CC=C2C=C1C(C)=O D71912 [0,2,0,0,0,0|1,0,0]=3 480 B16R2.23520 O=C(O)C1=CC2=C(C=C(O)C=C2)OC1=O 90276 [0,2,0,0,0,0|2,0,0]=4 481 B16R2.23521 CC(=O)C1=CC2=C(C=CC(Br)=C2)OC1=O T70578 [0,2,0,0,0,0|1,0,0]=3 482 B16R2.23521 CC1=C(C(=O)O)C=C2C=C(Br)C=CC2=N1 88472 [0,2,0,0,0,0|2,0,0]=4 483 B16R2.33941 COC(=O)C1=CC2=C(C=CC=C2)NC1=O 37147 [0,2,0,0,0,0|1,0,0]=3 484 B16R2.33941 COC(=O)C1=CC2=CC=CC=C2N=C1Cl P10338 [0,2,0,0,0,0|1,0,0]=3 485 B16R2.33941 COC(=O)C1=CC2=CC=NC=C2N=C1Cl 54278 [0,2,0,0,0,0|2,0,0]=4 486 B16R2.83668 CN1C(=O)C(C(=O)O)=CC2=C1C=CC=C2 D82822 [0,2,0,0,0,0|2,0,0]=4 487 B16R2.83668 O=C(O)C1=CC2=CC=CC=C2C(Br)=C1O T70581 [0,2,0,0,0,0|1,0,0]=3 488 B16R2.442 CCC(CC)C1=CC2=CC=CC=C2C=C1 H11574 [0,2,0,0,0,0|1,0,1]=4 489 B16R2.767 CCOC(=O)C1=CC2=CC=NC=C2N=C1 80938 [0,2,0,0,0,0|2,0,0]=4 490 B16R2.767 CCOC(=O)C1=CC2=CN=CC=C2C=C1 C75065 [0,2,0,0,0,0|1,0,0]=3 491 B16R2.767 CCOC(=O)C1=CC2=NC=CN=C2C=C1 BL004086 [0,2,0,0,0,0|2,0,0]=4 492 B16R2.767 C[C@H](NC=O)C1=CC2=CC=CC=C2C=C1 C13085 [0,2,0,0,0,0|0,0,1]=3 493 B16R2.1205 COC(=O)C1=CC2=CC(N)=CC=C2N=C1 K10012 [0,2,0,0,0,0|1,0,0]=3 494 B16R2.1205 COC(=O)C1=CC2=CC(O)=CC=C2C=C1 N13256 [0,2,0,0,0,0|0,0,0]=2 495 B16R2.1205 COC(=O)C1=CC2=NC(N)=CC=C2N=C1 K10114 [0,2,0,0,0,0|2,0,0]=4 496 B16R2.1205 COC(=O)C1=CC=C2C=NC(Cl)=CC2=C1 79270 [0,2,0,0,0,0|1,0,0]=3 497 B16R2.1205 COC(=O)C1=CC=C2C=NC(Cl)=NC2=C1 37430 [0,2,0,0,0,0|2,0,0]=4 498 B16R2.1205 COC(=O)C1=CC=C2N=CC(Br)=CC2=C1 33288 [0,2,0,0,0,0|1,0,0]=3 499 B16R2.1205 COC(=O)C1=CC=C2N=CC(Cl)=CC2=C1 P19387 [0,2,0,0,0,0|1,0,0]=3 500 B16R2.1205 COC(=O)C1=CN=C2C=CC(Br)=CC2=C1 S12254 [0,2,0,0,0,0|1,0,0]=3 501 B16R2.1212 COC(=O)C1=CC2=C(C=CNC2=O)C=C1 O11843 [0,2,0,0,0,0|1,0,0]=3 502 B16R2.1212 COC(=O)C1=CC2=C(O)N=CN=C2C=C1 21075 [0,2,0,0,0,0|2,0,0]=4 503 B16R2.1212 COC(=O)C1=CC=C2C=CN=C(Cl)C2=C1 D79788 [0,2,0,0,0,0|1,0,0]=3 504 B16R2.1212 COC(=O)C1=CC=C2N=CN=C(Cl)C2=C1 68708 [0,2,0,0,0,0|2,0,0]=4 505 B16R2.33799 COC(=O)C1=CC2=C(C=C1)NC(=O)N=C2 F15825 [0,2,0,0,0,0|2,0,0]=4 506 B16R2.33799 COC(=O)C1=CC2=CC=C(N)C=C2N=C1 K10157 [0,2,0,0,0,0|1,0,0]=3 507 B16R2.33799 COC(=O)C1=CC2=CC=C(N)N=C2C=C1 K10093 [0,2,0,0,0,0|1,0,0]=3 508 B16R2.33799 COC(=O)C1=CC2=CC=C(N)N=C2N=C1 D85412 [0,2,0,0,0,0|2,0,0]=4 509 B16R2.33799 COC(=O)C1=CC2=CC=C(O)N=C2C=C1 F53456 [0,2,0,0,0,0|1,0,0]=3 510 B16R2.33799 COC(=O)C1=CC=C2C=C(Cl)N=CC2=C1 79489 [0,2,0,0,0,0|1,0,0]=3 511 B16R2.33799 COC(=O)C1=CC=C2C=C(F)C=CC2=C1 T72530 [0,2,0,0,0,0|0,0,0]=2 512 B16R2.33799 COC(=O)C1=CC=C2N=C(Cl)N=CC2=C1 37428 [0,2,0,0,0,0|2,0,0]=4 513 B16R2.33799 COC(=O)C1=CN=C2C=C(Br)C=CC2=C1 C13964 [0,2,0,0,0,0|1,0,0]=3 514 B16R2.33799 COC(=O)C1=NC2=CC=C(O)C=C2C=C1 P12374 [0,2,0,0,0,0|1,0,0]=3 515 B16R2.33799 COC(=O)C1=NC=C2C=C(Cl)C=CC2=C1 50705 [0,2,0,0,0,0|1,0,0]=3 516 B16R2.33799 O=C(CBr)C1=CC=C2C=C(Br)C=CC2=C1 90944 [0,2,0,0,0,0|0,0,0]=2 517 B16R2.33887 COC(=O)C1=CC(=O)C2=C(C=CC=C2)O1 AC4956 [0,2,0,0,0,0|1,0,0]=3 518 B16R2.33887 COC(=O)C1=CC2=C(C=CC=C2)C(=O)N1 C77631 [0,2,0,0,0,0|1,0,0]=3 519 B16R2.33887 COC(=O)C1=CC2=CC=CC=C2C(Cl)=N1 D74795 [0,2,0,0,0,0|1,0,0]=3 520 B16R2.33887 COC(=O)C1=CC2=CC=CC=C2C(O)=C1 F51618 [0,2,0,0,0,0|0,0,0]=2 521 B16R2.33887 COC(=O)C1=NC2=CC=CC=C2C(Cl)=C1 AC2439 [0,2,0,0,0,0|1,0,0]=3 522 B16R2.173132 COC(=O)C1=CC2=C(C=C1)C(=O)C=CN2 63718 [0,2,0,0,0,0|1,0,0]=3 523 B16R2.173132 COC(=O)C1=CC2=CC=NC(N)=C2C=C1 87796 [0,2,0,0,0,0|1,0,0]=3 524 B16R2.173132 COC(=O)C1=CC=C2C(=C1)C=CN=C2Cl 87797 [0,2,0,0,0,0|1,0,0]=3 525 B16R2.173132 COC(=O)C1=CC=C2C(Br)=CC=CC2=C1 P16931 [0,2,0,0,0,0|0,0,0]=2 526 B16R2.173132 COC(=O)C1=CC=C2C(Br)=CC=CC2=N1 27261 [0,2,0,0,0,0|1,0,0]=3 527 B16R2.173132 COC(=O)C1=CC=C2C(Br)=CC=NC2=C1 AT26686 [0,2,0,0,0,0|1,0,0]=3 528 B16R2.11974 CS(=O)(=O)C1=CC=C2N=CC(Br)=CC2=C1 K10044 [0,2,0,0,0,0|2,0,0]=4 529 B16R2.11987 O=S(=O)(Cl)C1=CC2=CC=C(Cl)C=C2C=C1 F11302 [0,2,0,0,0,0|2,0,0]=4 530 B16R2.26103 CC1=CC(C)=C2N=CC(C(=O)O)=CC2=C1 D93288 [0,2,0,0,0,0|2,0,0]=4 531 B16R2.26103 O=C(O)C1=CC=C2C(=C1)C=C(Cl)N=C2Cl D79846 [0,2,0,0,0,0|2,0,0]=4 532 B16R2.26103 O=C(O)C1=CN=C2C(F)=CC(Br)=CC2=C1 P20124 [0,2,0,0,0,0|2,0,0]=4 533 B16R2.133406 O=C(O)C1=CC(=O)C2=C(C=C(Br)C=C2)O1 W18978 [0,2,0,0,0,0|2,0,0]=4 534 B16R2.133406 O=C(O)C1=CC(=O)C2=C(C=C(F)C=C2)O1 C72176 [0,2,0,0,0,0|2,0,0]=4 535 B16R2.133406 O=C(O)C1=CC(O)=C2C=CC(Cl)=CC2=N1 P15444 [0,2,0,0,0,0|2,0,0]=4 536 B16R2.7486 CN(C)C1=CC=C2C=C(C=O)C=CC2=C1 27351 [0,2,0,0,0,0|2,0,0]=4 537 B16R2.7486 COC1=NC=C2C=C(C(=O)O)C=CC2=C1 C91487 [0,2,0,0,0,0|2,0,0]=4 538 B16R2.11989 CN1C(=O)C=CC2=C1C=CC(C(=O)O)=C2 F53568 [0,2,0,0,0,0|2,0,0]=4 539 B16R2.23501 O=C(O)C1=CC(Cl)=C2C=C(Br)C=CC2=N1 73848 [0,2,0,0,0,0|2,0,0]=4 540 B16R2.26112 CC1=CC(N)=C2C=C(C(=O)O)C=CC2=N1 D84233 [0,2,0,0,0,0|2,0,0]=4 541 B16R2.27376 CC(=O)C1=CC2=C(C=C1)OC(C)(C)C=C2 85635 [0,2,0,0,0,0|1,0,1]=4 542 B16R2.36806 COC1=C2N=CC(C(=O)O)=CC2=CC=C1 69462 [0,2,0,0,0,0|2,0,0]=4 543 B16R2.22890 O=C(O)C1=NC2=C(O)C=CC=C2C(O)=C1 C16038 [0,2,0,0,0,0|2,0,0]=4 544 B16R2.40082 COC1=CC(C(=O)O)=NC2=CC=CC=C21 D73297 [0,2,0,0,0,0|2,0,0]=4 545 B16R2.189541 COC1=C2C=C(C(=O)O)C=NC2=CC=C1 80329 [0,2,0,0,0,0|2,0,0]=4 546 B16R2.189541 COC1=C2N=C(C(=O)O)C=CC2=CC=C1 D70150 [0,2,0,0,0,0|2,0,0]=4 547 B14R2.31359 CC(=O)C1=CC=CC2=CC=CN=C21 92488 [0,0,1,1,0,0|1,0,0]=3 548 B14R2.31359 CC(=O)C1=CC=CC2=CC=NC=C21 78510 [0,0,1,1,0,0|1,0,0]=3 549 B14R2.31359 CC(C)C1=CC=CC2=CC=CC=C21 96984 [0,0,1,1,0,0|1,0,1]=4 550 B14R2.31359 C[C@H](O)C1=CC=CC2=CC=CC=C21 C15783 [0,0,1,1,0,0|0,0,2]=4 551 B14R2.31359 N=C(N)C1=CC=CC2=CC=CC=C21 F18397 [0,0,1,1,0,0|2,0,0]=4 552 B14R2.31359 NC(=O)C1=CN=CC2=CC=CC=C21 W16187 [0,0,1,1,0,0|2,0,0]=4 553 B14R2.31359 O=C(O)C1=CC=CC2=CC=NC=C21 90363 [0,0,1,1,0,0|2,0,0]=4 554 B16R3.335 NC1=NC2=C(C=CC3=CC=CC=C32)S1 C15742 [0,0,0,1,0,1|2,0,0]=4 555 B16R3.335 O=C1CC2=C(O1)C3=CC=CC=C3C=C2 D95149 [0,0,0,1,0,1|1,0,0]=3 556 B12R1.75 C=CC1=C(OC(C)=O)C=CC=C1 20662 [0,0,1,0,1,0|1,0,0]=3 557 B12R1.75 CC(=O)NC1=C(C=O)C=CC=C1 T70224 [0,0,1,0,1,0|2,0,0]=4 558 B12R2.1 O=CC1=CNC2=C1C=NC=C2 25652 [1,0,0,0,1,0|2,0,0]=4 559 B12R2.1 O=CC1=CNC2=CC=CN=C12 26610 [1,0,0,0,1,0|2,0,0]=4 560 B12R2.1 O=CC1=COC2=C1C=CC=C2 29951 [1,0,0,0,1,0|1,0,0]=3 561 B12R2.1 O=CC1=NC=C2C=CC=CN21 F14131 [1,0,0,0,1,0|2,0,0]=4 562 B12R2.32 O=CC1=CC2=C(C=CC=N2)N1 24171 [1,0,0,0,1,0|2,0,0]=4 563 B12R2.32 O=CC1=CC2=C(C=CC=N2)O1 P11151 [1,0,0,0,1,0|2,0,0]=4 564 B12R2.32 O=CC1=CC2=C(C=CN=C2)N1 69373 [1,0,0,0,1,0|2,0,0]=4 565 B12R2.32 O=CC1=CC2=C(C=CN=C2)S1 W19264 [1,0,0,0,1,0|2,0,0]=4 566 B12R2.32 O=CC1=CC2=C(C=NC=C2)N1 F53415 [1,0,0,0,1,0|2,0,0]=4 567 B12R2.32 O=CC1=CC2=C(N=CC=C2)N1 83174 [1,0,0,0,1,0|2,0,0]=4 568 B12R2.32 O=CC1=CC2=CC=CN=C2S1 F30586 [1,0,0,0,1,0|2,0,0]=4 569 B12R2.32 O=CC1=CN2C=CC=CC2=N1 20279 [1,0,0,0,1,0|2,0,0]=4 570 B12R2.44 COC1=CC2=C(C=C1)OC=C2 85079 [1,0,0,0,1,0|2,0,0]=4 571 B12R2.44 COC1=CC2=C(C=C1)SC=C2 63588 [1,0,0,0,1,0|2,0,0]=4 572 B12R2.44 O=CC1=CC2=C(C=C1)N=CO2 F11397 [1,0,0,0,1,0|2,0,0]=4 573 B12R2.44 O=CC1=CC2=C(C=C1)OC=N2 Y10438 [1,0,0,0,1,0|2,0,0]=4 574 B12R2.44 O=CC1=CC2=C(C=C1)SC=N2 F13990 [1,0,0,0,1,0|2,0,0]=4 575 B12R2.44 O=CC1=CC2=C(C=CS2)C=C1 F18049 [1,0,0,0,1,0|1,0,0]=3 576 B12R2.44 O=CC1=CC2=CC=NN2C=C1 51007 [1,0,0,0,1,0|2,0,0]=4 577 B12R2.44 O=CC1=CN=C2C=CNC2=C1 N10010 [1,0,0,0,1,0|2,0,0]=4 578 B12R2.44 O=CC1=CN=C2NC=CC2=C1 37223 [1,0,0,0,1,0|2,0,0]=4 579 B12R2.44 O=CC1=NC2=C(C=CN2)C=C1 27133 [1,0,0,0,1,0|2,0,0]=4 580 B12R2.44 O=CC1=NC=C2NC=CC2=C1 C72214 [1,0,0,0,1,0|2,0,0]=4 581 B12R2.44 O=CC1=NC=C2OC=CC2=C1 27730 [1,0,0,0,1,0|2,0,0]=4 582 B14R1.818 CC(=O)CC(=O)\C=C\C1=CC=CC=C1 30085 [0,0,1,0,0,1|1,0,0]=3 583 B14R2.1008 CC(=O)NC1=CC2=C(C=C1)NC=C2 76690 [0,0,0,0,1,1|1,0,0]=3 584 B14R2.1008 CC(=O)NC1=NC=C2NC=CC2=C1 C15097 [0,0,0,0,1,1|2,0,0]=4 585 B16R2.477 O=C(O)CCC1=CC2=CC=CC=C2N=C1 W13665 [0,0,0,0,0,2|2,0,0]=4 586 B16R2.477 O=C(O)\C=C\C1=CC2=CC=CC=C2C=C1 A12592 [0,0,0,0,0,2|1,0,0]=3