0 B12R2.18 Brc1c(Br)sc2c1cccc2 PI-40411 [0,0,0,0,0,0|4,0,0]=4 1 B12R2.18 C1C(C(C2=CC=CC=C21)O)Br PI-14453 [0,0,0,0,0,0|3,0,1]=4 2 B12R2.18 CC1C(NC2=CC=CC=C12)C PI-44123 [0,0,0,0,0,0|3,0,1]=4 3 B12R2.18 CC1C2=C(NC1=O)N=CC=C2 PI-41265 [0,0,0,0,0,0|3,0,0]=3 4 B12R2.18 CC1N(N)C2=C(C=CC=C2)C1 PI-36643 [0,0,0,0,0,0|3,0,1]=4 5 B12R2.18 CN1C2=CC=CC=C2N=C1N PI-30188 [0,0,0,0,0,0|2,0,1]=3 6 B12R2.18 Cc1[nH]c2ccccc2c1C PI-11086 [0,0,0,0,0,0|3,0,0]=3 7 B12R2.18 Cn1c(C)cc2c1cccc2 PI-11083 [0,0,0,0,0,0|3,0,0]=3 8 B12R2.18 NN1C(C)Cc2ccccc12 PI-16793 [0,0,0,0,0,0|3,0,1]=4 9 B12R2.18 O=C1C(=O)Nc2ccccc12 PI-31744 [0,0,0,0,0,0|1,0,1]=2 10 B12R2.18 O=C1OC2=CC=CC=C2C1C PI-37207 [0,0,0,0,0,0|3,0,0]=3 11 B11R2.1 B1(C2=CC=CC=C2CO1)O PI-25687 [1,0,0,0,0,0|3,0,0]=4 12 B11R2.1 C1=CC2=C(NC=C2Br)N=C1 PI-41228 [1,0,0,0,0,0|3,0,0]=4 13 B11R2.1 C1=CC2=C(NC=C2Cl)N=C1 PI-42708 [1,0,0,0,0,0|3,0,0]=4 14 B11R2.1 C1=CC=C2C(=C1)C(=CN2)Br PI-34828 [1,0,0,0,0,0|2,0,0]=3 15 B11R2.1 C1=CC=C2C(=C1)C(=CO2)Br PI-17445 [1,0,0,0,0,0|3,0,0]=4 16 B11R2.1 C1=CC=C2C(=C1)C(=CS2)Br PI-14249 [1,0,0,0,0,0|3,0,0]=4 17 B11R2.1 C1=CC=C2C(=C1)C(=CS2)O PI-14308 [1,0,0,0,0,0|2,0,0]=3 18 B11R2.1 C1=CC=C2C(=C1)C=CS2=O PI-14312 [1,0,0,0,0,0|2,0,1]=4 19 B11R2.1 C1=CC=C2C(=C1)C=NN2N PI-44096 [1,0,0,0,0,0|3,0,0]=4 20 B11R2.1 CC1=CSC2=CC=CC=C12 PI-26140 [1,0,0,0,0,0|3,0,0]=4 21 B11R2.1 CN1C2=CC=CC=C2N=N1 PI-17166 [1,0,0,0,0,0|2,0,1]=4 22 B11R2.1 CN1C=NC2=CC=CC=C21 PI-11703 [1,0,0,0,0,0|1,0,1]=3 23 B11R2.1 Cc1c[nH]c2c1cccc2 PI-10761 [1,0,0,0,0,0|2,0,0]=3 24 B11R2.1 ClC1=CNC2=C1C=NC=C2 PI-36987 [1,0,0,0,0,0|3,0,0]=4 25 B11R2.1 Cn1ccc2ccccc12 PI-11080 [1,0,0,0,0,0|2,0,0]=3 26 B11R2.1 NC1=CNC2=C1C=NC=C2 PI-36984 [1,0,0,0,0,0|3,0,0]=4 27 B11R2.1 On1nnc2ccccc12 PI-15275 [1,0,0,0,0,0|1,0,1]=3 28 B11R2.1 On1nnc2ccccc12 PI-15359 [1,0,0,0,0,0|1,0,1]=3 29 B11R2.10 C1=CC2=C(NC(=O)O2)N=C1 PI-13499 [1,0,0,0,0,0|2,0,0]=3 30 B11R2.10 C1=CC=C2C(=C1)C=C(O2)Br PI-45424 [1,0,0,0,0,0|3,0,0]=4 31 B11R2.10 C1=CC=C2C(=C1)C=C(S2)Br PI-40410 [1,0,0,0,0,0|3,0,0]=4 32 B11R2.10 C1=CC=C2C(=C1)N=C(S2)Cl PI-15671 [1,0,0,0,0,0|2,0,1]=4 33 B11R2.10 C1=CC=C2C(=C1)N=C(S2)F PI-23463 [1,0,0,0,0,0|2,0,1]=4 34 B11R2.10 C1=CC=C2C(=C1)N=C(S2)N PI-45314 [1,0,0,0,0,0|2,0,1]=4 35 B11R2.10 C1=CC=C2C(=C1)NC(=S)N2 PI-13021 [1,0,0,0,0,0|0,1,0]=2 36 B11R2.10 C1=CC=C2C(=C1)NC(=S)O2 PI-32430 [1,0,0,0,0,0|1,1,0]=3 37 B11R2.10 C1=CN=CC2=C1NC(=O)N2 PI-47254 [1,0,0,0,0,0|1,0,0]=2 38 B11R2.10 C1C(=O)CC2=CC=CC=C21 PI-11611 [1,0,0,0,0,0|2,0,0]=3 39 B11R2.10 C1C2=CC=CC=C2C=C1Br PI-24035 [1,0,0,0,0,0|3,0,0]=4 40 B11R2.10 CC1=CC2=CC=CC=C2C1 PI-30321 [1,0,0,0,0,0|3,0,0]=4 41 B11R2.10 CC1=CC2=CC=CC=C2N1 PI-31662 [1,0,0,0,0,0|2,0,0]=3 42 B11R2.10 CC1=CC2=CC=CC=C2S1 PI-29081 [1,0,0,0,0,0|3,0,0]=4 43 B11R2.10 CC1=NC2=CC=CC=C2N1 PI-11865 [1,0,0,0,0,0|1,0,1]=3 44 B11R2.10 CC1=NC2=CC=CC=C2O1 PI-11866 [1,0,0,0,0,0|2,0,1]=4 45 B11R2.10 CC1NC2=C(C=CC=C2)C1 PI-11338 [1,0,0,0,0,0|2,0,1]=4 46 B11R2.10 Clc1nc2c([nH]1)cccc2 PI-31005 [1,0,0,0,0,0|1,0,1]=3 47 B11R2.10 Clc1nc2ccccc2o1 PI-33937 [1,0,0,0,0,0|2,0,1]=4 48 B11R2.10 Ic1cc2c(s1)cccc2 PI-38228 [1,0,0,0,0,0|3,0,0]=4 49 B11R2.10 Nc1nc2c(s1)cccc2 PI-31667 [1,0,0,0,0,0|2,0,1]=4 50 B11R2.10 Nc1nc2ccccc2[nH]1 PI-31350 [1,0,0,0,0,0|1,0,1]=3 51 B11R2.10 Nc1nc2ccccc2o1 PI-17283 [1,0,0,0,0,0|2,0,1]=4 52 B11R2.10 O=C1Cc2c(N1)cccc2 PI-11084 [1,0,0,0,0,0|1,0,0]=2 53 B11R2.10 O=C1Cc2ccccc2O1 PI-18682 [1,0,0,0,0,0|2,0,0]=3 54 B11R2.10 O=c1oc2ccccc2[nH]1 PI-11480 [1,0,0,0,0,0|1,0,0]=2 55 B11R2.10 O=c1sc2ccccc2[nH]1 PI-12052 [1,0,0,0,0,0|1,0,0]=2 56 B11R2.10 Oc1nc2ccccc2[nH]1 PI-16421 [1,0,0,0,0,0|0,0,2]=3 57 B11R2.10 Sc1nc2c(s1)cccc2 PI-33935 [1,0,0,0,0,0|1,1,1]=4 58 B13R2.45 CC1=C(SC2=CC=CC=C12)C=O PI-29352 [0,1,0,0,0,0|3,0,0]=4 59 B13R2.135 CC1=C(C2=CC=CC=C2N1)C=O PI-10994 [0,1,0,0,0,0|2,0,1]=4 60 B13R2.135 CC1=NC2=CC=CC=C2N1CF PI-46460 [0,1,0,0,0,0|2,0,1]=4 61 B13R2.135 CCN1C(=NC2=CC=CC=C21)C PI-32333 [0,1,0,0,0,0|2,0,1]=4 62 B13R2.3028 C1=CC2=C(C=C1Br)C(=O)C(=O)N2 PI-20345 [0,1,0,0,0,0|1,0,1]=3 63 B13R2.3028 C1=CC2=C(C=C1Cl)C(=O)C(=O)N2 PI-11529 [0,1,0,0,0,0|1,0,1]=3 64 B13R2.3028 Cc1ccc2c(c1)C(=O)C(=O)N2 PI-11530 [0,1,0,0,0,0|1,0,1]=3 65 B13R2.3028 Fc1ccc2c(c1)C(=O)C(=O)N2 PI-22671 [0,1,0,0,0,0|1,0,1]=3 66 B13R2.3028 Ic1ccc2c(c1)C(=O)C(=O)N2 PI-18328 [0,1,0,0,0,0|1,0,1]=3 67 B13R2.3085 O=C1c2ccccc2N(C1=O)C PI-30280 [0,1,0,0,0,0|1,0,1]=3 68 B13R2.4825 C1=CC=C(Br)C2=C1C(=O)C(=O)N2 PI-35969 [0,1,0,0,0,0|1,0,1]=3 69 B13R2.4825 C1=CC=C(C2=C1C(C(=O)N2)=O)Cl PI-10411 [0,1,0,0,0,0|1,0,1]=3 70 B13R2.4825 O=C1Nc2c(F)cccc2C1=O PI-28370 [0,1,0,0,0,0|1,0,1]=3 71 B13R2.4825 O=C1Nc2c(I)cccc2C1=O PI-35973 [0,1,0,0,0,0|1,0,1]=3 72 B13R2.4856 C1=CC2=C(C(=C1)Br)C(=O)C(=O)N2 PI-35975 [0,1,0,0,0,0|1,0,1]=3 73 B13R2.4856 FC1=C2C(=CC=C1)NC(C2=O)=O PI-40288 [0,1,0,0,0,0|1,0,1]=3 74 B13R2.4856 O=C1Nc2cccc(I)c2C1=O PI-35976 [0,1,0,0,0,0|1,0,1]=3 75 B13R2.5190 C1=CC2=C(C=C1Br)NC(=O)C2=O PI-44938 [0,1,0,0,0,0|1,0,1]=3 76 B13R2.5190 C1=CC2=C(C=C1F)NC(=O)C2=O PI-40287 [0,1,0,0,0,0|1,0,1]=3 77 B13R2.5190 Clc1ccc2c(c1)NC(=O)C2=O PI-10574 [0,1,0,0,0,0|1,0,1]=3 78 B13R2.5190 Ic1ccc2c(c1)NC(=O)C2=O PI-35977 [0,1,0,0,0,0|1,0,1]=3 79 B11R1.36 C1=CC=C(C=C1)C(C(=O)O)Br PI-12709 [0,0,1,0,0,0|3,0,0]=4 80 B11R1.36 C1=CC=C(C=C1)C(C(=O)O)N PI-18442 [0,0,1,0,0,0|3,0,0]=4 81 B11R1.36 C1=CC=C(C=C1)C(C(=O)O)O PI-33913 [0,0,1,0,0,0|2,0,0]=3 82 B11R1.36 C=C(C1=CC=CC=C1)C(=O)O PI-11241 [0,0,1,0,0,0|3,0,0]=4 83 B11R1.36 CC(C(=O)O)c1ccccc1 PI-11879 [0,0,1,0,0,0|3,0,0]=4 84 B11R1.36 CC(C1=CC=CC=C1)C(=O)O PI-10358 [0,0,1,0,0,0|3,0,0]=4 85 B11R1.36 CN(C1=CC=CC=C1)C(=S)Cl PI-24196 [0,0,1,0,0,0|2,1,0]=4 86 B11R1.36 C[C@@H](c1ccccc1)C(=O)O PI-10357 [0,0,1,0,0,0|3,0,0]=4 87 B11R1.36 FC(C(=O)O)c1ccccc1 PI-30175 [0,0,1,0,0,0|3,0,0]=4 88 B11R1.36 N[C@@H](c1ccccc1)C(=O)N PI-37984 [0,0,1,0,0,0|2,0,0]=3 89 B11R1.36 O=C(C(=O)C)c1ccccc1 PI-32566 [0,0,1,0,0,0|2,0,1]=4 90 B11R1.36 O=C(C(=O)O)c1ccccc1 PI-30769 [0,0,1,0,0,0|2,0,1]=4 91 B11R1.36 O[C@@H](C(=O)O)c1ccccc1 PI-10352 [0,0,1,0,0,0|2,0,0]=3 92 B11R1.36 O[C@@H](c1ccccc1)C(=O)O PI-10351 [0,0,1,0,0,0|2,0,0]=3 93 B11R1.40 C1=CC=C(C=C1)CC(=O)NN PI-30983 [0,0,1,0,0,0|2,0,0]=3 94 B11R1.40 C1=CC=C(C=C1)NC(=S)NN PI-29671 [0,0,1,0,0,0|1,1,0]=3 95 B11R1.40 C=CC(OC1=CC=CC=C1)=O PI-41188 [0,0,1,0,0,0|3,0,0]=4 96 B11R1.40 CCC(=O)CC1=CC=CC=C1 PI-47129 [0,0,1,0,0,0|3,0,0]=4 97 B11R1.40 CNC(=S)Nc1ccccc1 PI-24288 [0,0,1,0,0,0|1,1,0]=3 98 B11R1.40 CNC(=S)Nc1ccccc1 PI-30591 [0,0,1,0,0,0|1,1,0]=3 99 B11R1.40 ClCC(=O)Nc1ccccc1 PI-15656 [0,0,1,0,0,0|2,0,0]=3 100 B13R2.32 Brc1ccc2c(c1O)cccc2 PI-39182 [0,0,0,0,0,1|3,0,0]=4 101 B13R2.32 C1=CC=C2C(=C1)C=CC(=C2O)F PI-18694 [0,0,0,0,0,1|3,0,0]=4 102 B13R2.32 C1=CC=C2C(=C1)C=CC(=C2O)N PI-18543 [0,0,0,0,0,1|3,0,0]=4 103 B13R2.32 C1=CC=C2C(=C1)C=CC(=C2O)O PI-25690 [0,0,0,0,0,1|2,0,1]=4 104 B13R2.32 C1=CC=C2C(=C1)C=CC(=O)C2=O PI-25638 [0,0,0,0,0,1|2,0,1]=4 105 B13R2.32 C1=CC=C2C(=C1)C=NC(=C2O)Cl PI-44810 [0,0,0,0,0,1|2,0,1]=4 106 B13R2.32 C1=CC=C2C(=C1)C=NC(=C2O)Cl PI-44835 [0,0,0,0,0,1|2,0,1]=4 107 B13R2.32 CC1=C(C2=CC=CC=C2C=C1)O PI-18875 [0,0,0,0,0,1|3,0,0]=4 108 B13R2.32 CC1C(=O)CCC2=CC=CC=C12 PI-17164 [0,0,0,0,0,1|3,0,0]=4 109 B13R2.32 OC1=C(Br)C=CC2=C1C=CC=C2 PI-39181 [0,0,0,0,0,1|3,0,0]=4 110 B13R2.328 C1=CC2=C(NC(=O)NC2=O)N=C1 PI-50203 [0,0,0,0,0,1|2,0,1]=4 111 B13R2.328 C1=CC=C2C(=C1)C(=CC(=O)N2)[O-] PI-29605 [0,0,0,0,0,1|1,0,1]=3 112 B13R2.328 C1=CC=C2C(=C1)C(=O)C=C(N2)N PI-29594 [0,0,0,0,0,1|2,0,1]=4 113 B13R2.328 C1=CC=C2C(=C1)C(=O)NC(=S)N2 PI-29128 [0,0,0,0,0,1|1,1,1]=4 114 B13R2.328 C1C2=CC=CC=C2C(=O)NC1=O PI-40295 [0,0,0,0,0,1|2,0,1]=4 115 B13R2.328 Cc1cc(O)c2c(n1)cccc2 PI-29750 [0,0,0,0,0,1|2,0,1]=4 116 B13R2.328 O=C1OC(=O)c2c(C1)cccc2 PI-16185 [0,0,0,0,0,1|2,0,1]=4 117 B13R2.328 O=c1cc(O)c2ccccc2o1 PI-31737 [0,0,0,0,0,1|2,0,0]=3 118 B13R2.328 Oc1cc(O)c2c(n1)cccc2 PI-16408 [0,0,0,0,0,1|1,0,2]=4 119 B13R2.328 Oc1cc2ccccc2c(c1)O PI-25115 [0,0,0,0,0,1|2,0,1]=4 120 B13R2.369 C1=CC=C2C=C(C(=CC2=C1)N)O PI-25656 [0,0,0,0,0,1|3,0,0]=4 121 B13R2.369 O=c1oc2ccccc2cc1N PI-17434 [0,0,0,0,0,1|3,0,0]=4 122 B13R2.369 Oc1cc2ccccc2cc1O PI-32469 [0,0,0,0,0,1|2,0,1]=4 123 B10R1.15 C1=CC=C(C=C1)C(=O)C=O PI-30054 [1,0,1,0,0,0|1,0,1]=4 124 B10R1.15 C1=CC=C(C=C1)C(CN)O PI-30384 [1,0,1,0,0,0|1,0,1]=4 125 B10R1.15 NCC(O)c1ccccc1 PI-17268 [1,0,1,0,0,0|1,0,1]=4 126 B10R1.15 NC[C@H](c1ccccc1)O PI-30721 [1,0,1,0,0,0|1,0,1]=4 127 B10R1.18 C1=CC(=CN=C1)CC(=O)O PI-13521 [1,0,1,0,0,0|2,0,0]=4 128 B10R1.18 C1=CC(=CN=C1)CC(=O)O PI-16758 [1,0,1,0,0,0|2,0,0]=4 129 B10R1.18 C1=CC=C(C=C1)N=C(N)N PI-11304 [1,0,1,0,0,0|1,0,1]=4 130 B10R1.18 C1=CC=C(C=C1)OC(=O)N PI-10948 [1,0,1,0,0,0|1,0,0]=3 131 B10R1.18 C1=CC=NC(=C1)CC(=O)O PI-16725 [1,0,1,0,0,0|2,0,0]=4 132 B10R1.18 C1=CC=[N+](C=C1)CC(=O)N PI-15939 [1,0,1,0,0,0|2,0,0]=4 133 B10R1.18 NC(=Nc1ccccc1)N PI-20950 [1,0,1,0,0,0|1,0,1]=4 134 B10R1.18 OC(=O)Cc1cccnc1 PI-28588 [1,0,1,0,0,0|2,0,0]=4 135 B10R1.18 OC(=O)Cc1ccncc1 PI-16726 [1,0,1,0,0,0|2,0,0]=4 136 B10R1.4 C=CCC1=CC=CC=C1O PI-46039 [1,0,1,0,0,0|2,0,0]=4 137 B10R1.20 C#CC1=CC=CC=C1C=O PI-26604 [1,0,1,0,0,0|2,0,0]=4 138 B10R1.20 C1=CC=C(C(=C1)C=O)C#N PI-11835 [1,0,1,0,0,0|2,0,0]=4 139 B10R1.20 CCC1=CC=CC=C1C=O PI-35265 [1,0,1,0,0,0|2,0,0]=4 140 B10R1.20 CSC1=CC=CC=C1C=O PI-27861 [1,0,1,0,0,0|2,0,0]=4 141 B10R1.20 O=Cc1ccccc1C=O PI-31254 [1,0,1,0,0,0|1,0,1]=4 142 B10R1.61 B(C1=CC=CC=C1N)(O)O PI-31530 [1,0,1,0,0,0|1,0,1]=4 143 B10R1.61 C1=CC=C(C(=C1)C(=O)O)I PI-18960 [1,0,1,0,0,0|2,0,0]=4 144 B10R1.61 C1=CC=C(C(=C1)C(=O)O)S PI-40146 [1,0,1,0,0,0|2,0,0]=4 145 B10R1.61 C1=CN=CC(=C1C(=O)O)N PI-33158 [1,0,1,0,0,0|2,0,0]=4 146 B10R1.61 CC(=O)C1=CC=CC=C1N PI-29399 [1,0,1,0,0,0|2,0,0]=4 147 B10R1.61 CC(=O)c1ccccc1N PI-11796 [1,0,1,0,0,0|2,0,0]=4 148 B10R1.61 CC(O)C1=CC=CC=C1N PI-46775 [1,0,1,0,0,0|1,0,1]=4 149 B10R1.61 OC(=O)c1ccccc1F PI-16976 [1,0,1,0,0,0|2,0,0]=4 150 B10R1.61 OC(=O)c1cccnc1N PI-31221 [1,0,1,0,0,0|2,0,0]=4 151 B10R1.61 OC(=O)c1ccncc1N PI-10177 [1,0,1,0,0,0|2,0,0]=4 152 B10R1.61 OC(=O)c1cnccc1N PI-10029 [1,0,1,0,0,0|2,0,0]=4 153 B10R1.61 OC(=O)c1ncccc1N PI-14129 [1,0,1,0,0,0|2,0,0]=4 154 B10R2.7 C1=CC=C2C(=C1)C=CN2 PI-44715 [2,0,0,0,0,0|1,0,0]=3 155 B10R2.7 C1=CC=C2C(=C1)N=CO2 PI-47002 [2,0,0,0,0,0|1,0,1]=4 156 B10R2.7 C1=CC=C2C(=C1)SC=[S+]2 PI-14799 [2,0,0,0,0,0|2,0,0]=4 157 B10R2.7 C1=C[NH]C2=C1C=CN=C2 PI-10410 [2,0,0,0,0,0|2,0,0]=4 158 B10R2.7 C1=C[NH]C2=C1C=NC=C2 PI-10409 [2,0,0,0,0,0|2,0,0]=4 159 B10R2.7 C1CNC2=CC=CC=C21 PI-44710 [2,0,0,0,0,0|1,0,1]=4 160 B10R2.7 c1ccc2c(c1)[nH]cn2 PI-31348 [2,0,0,0,0,0|0,0,1]=3 161 B10R2.7 c1ccc2c(c1)[nH]nc2 PI-31379 [2,0,0,0,0,0|2,0,0]=4 162 B10R2.7 c1ccc2ccsc2c1 PI-14247 [2,0,0,0,0,0|2,0,0]=4 163 B10R2.7 c1cnc2[nH]ccc2c1 PI-16515 [2,0,0,0,0,0|2,0,0]=4 164 B10R2.7 c1cnc2c(c1)[nH]cc2 PI-10408 [2,0,0,0,0,0|2,0,0]=4 165 B12R1.20 C1=CC(=CC=C1C(C(=O)O)O)Br PI-12127 [0,1,1,0,0,0|2,0,0]=4 166 B12R1.20 C1=CC(=CC=C1C(C(=O)O)O)Cl PI-11218 [0,1,1,0,0,0|2,0,0]=4 167 B12R1.20 OC(c1ccc(cc1)F)C(=O)O PI-12126 [0,1,1,0,0,0|2,0,0]=4 168 B12R1.34 C1=CC=C(C=C1)C(C(=O)NN)O PI-50234 [0,1,1,0,0,0|1,0,0]=3 169 B12R1.34 COC(=O)C(C1=CC=CC=C1)O PI-31834 [0,1,1,0,0,0|2,0,0]=4 170 B12R1.34 COC(=O)C(C1=CC=CC=C1)O PI-31835 [0,1,1,0,0,0|2,0,0]=4 171 B12R1.124 C1=CC=C(C(=C1)C(C(=O)O)O)Cl PI-11222 [0,1,1,0,0,0|2,0,0]=4 172 B12R1.124 C1=CC=C(C(=C1)C(C(=O)O)O)Cl PI-11225 [0,1,1,0,0,0|2,0,0]=4 173 B12R1.124 OC(=O)C(c1ccccc1Br)O PI-12128 [0,1,1,0,0,0|2,0,0]=4 174 B12R1.124 OC(=O)C(c1ccccc1Cl)O PI-11216 [0,1,1,0,0,0|2,0,0]=4 175 B12R1.124 OC(=O)[C@@H](c1ccccc1F)O PI-36868 [0,1,1,0,0,0|2,0,0]=4 176 B12R1.225 OC(=O)C(O)c1cccc(Br)c1 PI-21550 [0,1,1,0,0,0|2,0,0]=4 177 B12R1.225 OC(=O)C(O)c1cccc(C)c1 PI-24801 [0,1,1,0,0,0|2,0,0]=4 178 B12R1.225 O[C@H](C1=CC=CC(Cl)=C1)C(O)=O PI-37323 [0,1,1,0,0,0|2,0,0]=4 179 B12R1.253 C1=CC=C(C=C1)C(C(=O)N)(F)F PI-12515 [0,1,1,0,0,0|2,0,0]=4 180 B12R1.253 CC(C1=CC=CC=C1)(C(=O)O)O PI-19096 [0,1,1,0,0,0|2,0,0]=4 181 B12R1.253 CC(C1=CC=CC=C1)(C(=O)O)O PI-19536 [0,1,1,0,0,0|2,0,0]=4 182 B12R1.478 C1=CC=C(C=C1)C(CO)C(=O)O PI-10781 [0,1,1,0,0,0|2,0,0]=4 183 B12R1.32 CCOC(=O)NC1=CC=CC=C1 PI-50683 [0,1,1,0,0,0|2,0,0]=4 184 B12R1.43 CN(C(=O)NC1=CC=CC=C1)O PI-20818 [0,1,1,0,0,0|0,0,0]=2 185 B12R1.43 O=C(C(=O)O)Cc1ccccc1 PI-12929 [0,1,1,0,0,0|2,0,0]=4 186 B12R1.49 C1=CC(=CC=C1CC(=O)NN)Cl PI-50326 [0,1,1,0,0,0|2,0,0]=4 187 B12R1.49 C1=CC(=CC=C1CC(=O)NN)F PI-50267 [0,1,1,0,0,0|2,0,0]=4 188 B12R1.49 C1=CC(=CC=C1CC(=O)NN)O PI-50261 [0,1,1,0,0,0|2,0,0]=4 189 B12R1.49 C1=CC(=CC=C1NC(=O)CCl)Cl PI-20206 [0,1,1,0,0,0|2,0,0]=4 190 B12R1.49 C1=CC(=CC=C1NC(=O)CCl)F PI-15659 [0,1,1,0,0,0|2,0,0]=4 191 B12R1.49 C1=CC(=CC=C1NC(=S)NN)Br PI-22564 [0,1,1,0,0,0|1,1,0]=4 192 B12R1.49 C1=CC(=CC=C1NC(=S)NN)Cl PI-29363 [0,1,1,0,0,0|1,1,0]=4 193 B12R1.49 CC1=CC=C(C=C1)CC(=O)NN PI-50599 [0,1,1,0,0,0|2,0,0]=4 194 B12R1.49 NNC(=S)Nc1ccc(cc1)C PI-24092 [0,1,1,0,0,0|1,1,0]=4 195 B12R1.50 C1=CC(=CC(=C1)Cl)CC(=O)NN PI-50254 [0,1,1,0,0,0|2,0,0]=4 196 B12R1.50 C1=CC(=CC(=C1)F)NC(=O)CCl PI-23121 [0,1,1,0,0,0|2,0,0]=4 197 B12R1.50 CCC(=O)NC1=CC=CC(=C1)N PI-30343 [0,1,1,0,0,0|2,0,0]=4 198 B12R1.50 CNC(=O)CC1=CC(=CC=C1)N PI-36757 [0,1,1,0,0,0|2,0,0]=4 199 B12R1.371 C1=CC=C(C(=C1)CC(=O)NN)Cl PI-50255 [0,1,1,0,0,0|2,0,0]=4 200 B12R1.371 C1=CC=C(C(=C1)CC(=O)NN)F PI-50405 [0,1,1,0,0,0|2,0,0]=4 201 B12R1.371 C1=CC=C(C(=C1)NC(=S)NN)F PI-29541 [0,1,1,0,0,0|1,1,0]=4 202 B12R1.371 CC1=CC=CC=C1NC(=S)NN PI-29766 [0,1,1,0,0,0|1,1,0]=4 203 B12R2.1 C1=CC=C2C(=C1)C(=CN2)C=O PI-16169 [1,1,0,0,0,0|1,0,1]=4 204 B12R2.1 C1=CC=CC2=C1[NH]C=C2C#N PI-10233 [1,1,0,0,0,0|2,0,0]=4 205 B12R2.1 CCN1C=NC2=C1C=CC=C2 PI-32332 [1,1,0,0,0,0|1,0,1]=4 206 B12R2.1 OCc1c[nH]c2c1cccc2 PI-16182 [1,1,0,0,0,0|1,0,0]=3 207 B12R2.132 CC1=CNC2=C1C=C(C=C2)F PI-22695 [1,1,0,0,0,0|2,0,0]=4 208 B12R2.132 Clc1ccc2nnn(O)c2c1 PI-17754 [1,1,0,0,0,0|1,0,1]=4 209 B12R2.132 Oc1ccc2c(c1)c(C)c[nH]2 PI-36560 [1,1,0,0,0,0|2,0,0]=4 210 B12R2.612 CN1C=CC2=C1C=CC(=C2)N PI-45196 [1,1,0,0,0,0|2,0,0]=4 211 B12R2.32 C1=CC=C2C(=C1)C=C(N2)CO PI-45001 [1,1,0,0,0,0|1,0,1]=4 212 B12R2.32 C1=CC=C2C(=C1)C=C(O2)C=O PI-16469 [1,1,0,0,0,0|2,0,0]=4 213 B12R2.32 C1=CC=C2C(=C1)C=C(S2)C=O PI-29507 [1,1,0,0,0,0|2,0,0]=4 214 B12R2.32 C1=CC=C2C(=C1)N=C(S2)C=O PI-14166 [1,1,0,0,0,0|1,0,1]=4 215 B12R2.32 C1=CC=C2C(=C1)NC(=N2)CN PI-45223 [1,1,0,0,0,0|1,0,1]=4 216 B12R2.32 C1=CC=C2C(=C1)NC(=N2)CO PI-14787 [1,1,0,0,0,0|0,0,2]=4 217 B12R2.32 ClCC1=NC2=CC=CC=C2N1 PI-16189 [1,1,0,0,0,0|1,0,1]=4 218 B12R2.32 N#CC=1NC2=C(C1)C=CC=C2 PI-46707 [1,1,0,0,0,0|2,0,0]=4 219 B12R2.32 O=Cc1cc2ccccc2[nH]1 PI-31918 [1,1,0,0,0,0|1,0,0]=3 220 B12R2.32 O=Cc1nc2c([nH]1)cccc2 PI-14803 [1,1,0,0,0,0|0,0,1]=3 221 B12R2.202 C1=CC(=C2C(=C1)SC(=O)N2)F PI-45347 [1,1,0,0,0,0|1,0,0]=3 222 B12R2.202 C1=CC(=C2C(=C1)SC(=S)N2)F PI-45334 [1,1,0,0,0,0|1,1,0]=4 223 B12R2.202 C1=CC2=C(C(=C1)Cl)NC(=S)S2 PI-45330 [1,1,0,0,0,0|1,1,0]=4 224 B12R2.202 C1=CC2=C(C(=C1)Cl)SC(=O)N2 PI-45344 [1,1,0,0,0,0|1,0,0]=3 225 B12R2.202 C1=CC2=C(C(=C1)Cl)SC(=S)N2 PI-45332 [1,1,0,0,0,0|1,1,0]=4 226 B12R2.202 C1C(=O)CC2=C1C=CC=C2Br PI-32756 [1,1,0,0,0,0|2,0,0]=4 227 B12R2.202 C1C(=O)CC2=C1C=CC=C2Cl PI-32755 [1,1,0,0,0,0|2,0,0]=4 228 B12R2.202 C1C2=C(C(=CC=C2)Cl)NC1=O PI-33957 [1,1,0,0,0,0|1,0,0]=3 229 B12R2.202 CC1=C2C(=CC=C1)SC(=O)N2 PI-45350 [1,1,0,0,0,0|1,0,0]=3 230 B12R2.202 CC1=C2C(=CC=C1)SC(=S)N2 PI-45337 [1,1,0,0,0,0|1,1,0]=4 231 B12R2.202 CC1=CC2=C(N1)C=CC=C2O PI-18492 [1,1,0,0,0,0|2,0,0]=4 232 B12R2.202 FC1=C2C(NC(Cl)=N2)=CC=C1 PI-46690 [1,1,0,0,0,0|1,0,1]=4 233 B12R2.202 O=C1NC2=C(C=CC=C2F)C1 PI-40280 [1,1,0,0,0,0|1,0,0]=3 234 B12R2.606 C1=CC2=C(C=C1Br)NC(=N2)Cl PI-47255 [1,1,0,0,0,0|1,0,1]=4 235 B12R2.606 C1=CC2=C(C=C1Br)NC(=O)N2 PI-45071 [1,1,0,0,0,0|0,0,0]=2 236 B12R2.606 C1=CC2=C(C=C1Br)NC(=O)S2 PI-45345 [1,1,0,0,0,0|1,0,0]=3 237 B12R2.606 C1=CC2=C(C=C1Br)NC(=S)N2 PI-45216 [1,1,0,0,0,0|0,1,0]=3 238 B12R2.606 C1=CC2=C(C=C1Br)NC(=S)S2 PI-32978 [1,1,0,0,0,0|1,1,0]=4 239 B12R2.606 C1=CC2=C(C=C1Br)SC(=O)N2 PI-45346 [1,1,0,0,0,0|1,0,0]=3 240 B12R2.606 C1=CC2=C(C=C1Br)SC(=S)N2 PI-45333 [1,1,0,0,0,0|1,1,0]=4 241 B12R2.606 C1=CC2=C(C=C1Cl)NC(=O)S2 PI-12815 [1,1,0,0,0,0|1,0,0]=3 242 B12R2.606 C1=CC2=C(C=C1Cl)NC(=S)N2 PI-19368 [1,1,0,0,0,0|0,1,0]=3 243 B12R2.606 C1=CC2=C(C=C1Cl)NC(=S)S2 PI-28622 [1,1,0,0,0,0|1,1,0]=4 244 B12R2.606 C1=CC2=C(C=C1Cl)OC(=O)N2 PI-12045 [1,1,0,0,0,0|1,0,0]=3 245 B12R2.606 C1=CC2=C(C=C1Cl)OC(=S)N2 PI-12043 [1,1,0,0,0,0|1,1,0]=4 246 B12R2.606 C1=CC2=C(C=C1Cl)SC(=O)N2 PI-45343 [1,1,0,0,0,0|1,0,0]=3 247 B12R2.606 C1=CC2=C(C=C1Cl)SC(=S)N2 PI-45331 [1,1,0,0,0,0|1,1,0]=4 248 B12R2.606 C1=CC2=C(C=C1F)NC(=O)S2 PI-45348 [1,1,0,0,0,0|1,0,0]=3 249 B12R2.606 C1=CC2=C(C=C1F)NC(=S)N2 PI-45213 [1,1,0,0,0,0|0,1,0]=3 250 B12R2.606 C1=CC2=C(C=C1F)NC(=S)S2 PI-45335 [1,1,0,0,0,0|1,1,0]=4 251 B12R2.606 C1=CC2=C(C=C1F)SC(=O)N2 PI-45349 [1,1,0,0,0,0|1,0,0]=3 252 B12R2.606 C1=CC2=C(C=C1F)SC(=S)N2 PI-45336 [1,1,0,0,0,0|1,1,0]=4 253 B12R2.606 C1=CC2=C(C=C1N)NC(=O)N2 PI-28900 [1,1,0,0,0,0|0,0,0]=2 254 B12R2.606 C1=CC2=C(C=C1N)SC(=O)N2 PI-45354 [1,1,0,0,0,0|1,0,0]=3 255 B12R2.606 C1C(=O)CC2=C1C=CC(=C2)Br PI-32762 [1,1,0,0,0,0|2,0,0]=4 256 B12R2.606 C1C(=O)CC2=C1C=CC(=C2)F PI-32760 [1,1,0,0,0,0|2,0,0]=4 257 B12R2.606 C1C2=C(C=C(C=C2)F)NC1=O PI-22722 [1,1,0,0,0,0|1,0,0]=3 258 B12R2.606 C1C2=C(C=C(C=C2)I)NC1=O PI-48996 [1,1,0,0,0,0|1,0,0]=3 259 B12R2.606 C1C2=C(C=CC(=C2)Cl)NC1=O PI-10011 [1,1,0,0,0,0|1,0,0]=3 260 B12R2.606 C1C2=C(C=CC(=C2)I)NC1=O PI-48127 [1,1,0,0,0,0|1,0,0]=3 261 B12R2.606 CC1=CC2=C(C=C1)N=C(N2)C PI-45227 [1,1,0,0,0,0|1,0,1]=4 262 B12R2.606 CC1=CC2=C(C=C1)NC(=C2)C PI-23861 [1,1,0,0,0,0|2,0,0]=4 263 B12R2.606 CC1=CC2=C(C=C1)NC(=O)S2 PI-45351 [1,1,0,0,0,0|1,0,0]=3 264 B12R2.606 CC1=CC2=C(C=C1)NC(=S)N2 PI-11853 [1,1,0,0,0,0|0,1,0]=3 265 B12R2.606 CC1=CC2=C(C=C1)NC(=S)S2 PI-45338 [1,1,0,0,0,0|1,1,0]=4 266 B12R2.606 CC1=CC2=C(C=C1)SC(=S)N2 PI-45342 [1,1,0,0,0,0|1,1,0]=4 267 B12R2.606 CC1=CC2=C(N1)C=CC(=C2)Br PI-18077 [1,1,0,0,0,0|2,0,0]=4 268 B12R2.606 CC1=CC2=C(N1)C=CC(=C2)F PI-21877 [1,1,0,0,0,0|2,0,0]=4 269 B12R2.606 CC1=CC2=C(N1)C=CC(=C2)N PI-14108 [1,1,0,0,0,0|2,0,0]=4 270 B12R2.606 CC1=CC2=C(N1)C=CC(=C2)O PI-27141 [1,1,0,0,0,0|2,0,0]=4 271 B12R2.606 CC1=NC2=C(N1)C=C(C=C2)Br PI-45019 [1,1,0,0,0,0|1,0,1]=4 272 B12R2.606 CC1=NC2=C(N1)C=C(C=C2)Cl PI-32334 [1,1,0,0,0,0|1,0,1]=4 273 B12R2.606 CC1=NC2=C(N1)C=C(C=C2)F PI-45214 [1,1,0,0,0,0|1,0,1]=4 274 B12R2.606 CC1=NC2=C(N1)C=C(C=C2)I PI-48362 [1,1,0,0,0,0|1,0,1]=4 275 B12R2.606 CC=1NC2=C(C1)C=CC(=C2)Br PI-46796 [1,1,0,0,0,0|2,0,0]=4 276 B12R2.606 Clc1ccc2[nH]c(C)cc2c1 PI-27064 [1,1,0,0,0,0|2,0,0]=4 277 B12R2.606 FC1=CC=C2C(N=C(Cl)N2)=C1 PI-46728 [1,1,0,0,0,0|1,0,1]=4 278 B12R2.606 NC1=CC=C2C(N=C(S)N2)=C1 PI-30424 [1,1,0,0,0,0|0,1,1]=4 279 B12R2.606 NC1=NC2=C(N1)C=C(Cl)C=C2 PI-11794 [1,1,0,0,0,0|1,0,1]=4 280 B12R2.606 O=C1CC2=C(C=C(Cl)C=C2)C1 PI-32761 [1,1,0,0,0,0|2,0,0]=4 281 B12R2.606 O=C1Cc2c(N1)cc(cc2)Br PI-14491 [1,1,0,0,0,0|1,0,0]=3 282 B12R2.606 O=C1Cc2ccc(Cl)cc2N1 PI-10012 [1,1,0,0,0,0|1,0,0]=3 283 B12R2.606 O=C1NC2=CC(F)=CC=C2N1 PI-46692 [1,1,0,0,0,0|0,0,0]=2 284 B12R2.606 O=C1Nc2c(C1)cc(cc2)Br PI-31105 [1,1,0,0,0,0|1,0,0]=3 285 B12R2.606 O=C1Nc2c(C1)cc(cc2)F PI-22697 [1,1,0,0,0,0|1,0,0]=3 286 B12R2.606 O=C1Nc2c(C1)cc(cc2)N PI-10591 [1,1,0,0,0,0|1,0,0]=3 287 B12R2.606 O=C1Nc2c(C1)cc(cc2)O PI-11085 [1,1,0,0,0,0|1,0,0]=3 288 B12R2.606 O=C1Oc2c(C1)cc(cc2)O PI-30406 [1,1,0,0,0,0|2,0,0]=4 289 B12R2.606 OC1=CC=C2SC(=O)OC2=C1 PI-34883 [1,1,0,0,0,0|2,0,0]=4 290 B14R2.92 C1=CC=C2C(=C1)C=CC(=C2O)N=O PI-18151 [0,1,0,0,0,1|2,0,0]=4 291 B14R2.7724 CN1C2=CC=CC=C2C(=CC1=O)O PI-30202 [0,1,0,0,0,1|2,0,0]=4 292 B14R2.8188 C1=CC=C2C(=C1)C(=C(C(=O)N2)Cl)O PI-32633 [0,1,0,0,0,1|2,0,0]=4 293 B14R2.1146 BrCc1cc(=O)[nH]c2c1cccc2 PI-16799 [0,1,0,0,0,1|2,0,0]=4 294 B14R2.8045 C1=CC2=C(C(=C1)Br)NC(=O)OC2=O PI-40283 [0,1,0,0,0,1|1,0,1]=4 295 B14R2.8045 C1=CC2=C(C(=C1)Cl)NC(=O)OC2=O PI-40282 [0,1,0,0,0,1|1,0,1]=4 296 B14R2.8045 C1C(=O)C2=C(C(=CC=C2)F)NC1=O PI-36208 [0,1,0,0,0,1|1,0,1]=4 297 B14R2.8045 CC1=C2C(=CC=C1)C(=O)OC(=O)N2 PI-18804 [0,1,0,0,0,1|1,0,1]=4 298 B14R2.8045 O=c1[nH]c2c(F)cccc2c(=O)[nH]1 PI-36139 [0,1,0,0,0,1|1,0,1]=4 299 B14R2.8045 O=c1[nH]c2c(I)cccc2c(=O)[nH]1 PI-36164 [0,1,0,0,0,1|1,0,1]=4 300 B14R2.8235 Brc1ccc2[nH]c(=O)[nH]c(=O)c2c1 PI-36145 [0,1,0,0,0,1|1,0,1]=4 301 B14R2.8235 Brc1ccc2c(c1)c(O)cc(=O)o2 PI-15397 [0,1,0,0,0,1|2,0,0]=4 302 B14R2.8235 C1=CC2=C(C=C1Br)C(=O)OC(=O)N2 PI-14459 [0,1,0,0,0,1|1,0,1]=4 303 B14R2.8235 C1=CC2=C(C=C1Cl)C(=O)OC(=O)N2 PI-18561 [0,1,0,0,0,1|1,0,1]=4 304 B14R2.8235 C1=CC2=C(C=C1O)C(=O)OC(=O)N2 PI-20780 [0,1,0,0,0,1|1,0,1]=4 305 B14R2.8235 CC1=CC2=C(C=C1)NC(=O)OC2=O PI-18557 [0,1,0,0,0,1|1,0,1]=4 306 B14R2.8235 CC1=CC2=C(C=C1)OC(=O)C=C2O PI-15406 [0,1,0,0,0,1|2,0,0]=4 307 B14R2.8235 Cc1ccc2[nH]c(=O)[nH]c(=O)c2c1 PI-36220 [0,1,0,0,0,1|1,0,1]=4 308 B14R2.8235 Clc1ccc2c(c1)c(O)cc(=O)o2 PI-15400 [0,1,0,0,0,1|2,0,0]=4 309 B14R2.8235 FC1=CC2=C(NC(=O)OC2=O)C=C1 PI-32993 [0,1,0,0,0,1|1,0,1]=4 310 B14R2.8235 Fc1ccc2[nH]c(=O)oc(=O)c2c1 PI-28121 [0,1,0,0,0,1|1,0,1]=4 311 B14R2.28480 C1=CC2=C(C(=C1)F)C(=O)NC(=O)N2 PI-36207 [0,1,0,0,0,1|1,0,1]=4 312 B14R2.28480 O=c1[nH]c2cccc(Br)c2c(=O)[nH]1 PI-36084 [0,1,0,0,0,1|1,0,1]=4 313 B14R2.29365 C1=CC2=C(C=C1Cl)NC(=O)OC2=O PI-18532 [0,1,0,0,0,1|1,0,1]=4 314 B14R2.29365 CC1=CC(=O)NC2=C1C=CC(=C2)N PI-35669 [0,1,0,0,0,1|2,0,0]=4 315 B14R2.29365 CC1=CC2=C(C=C1)C(=O)NC(=O)N2 PI-36221 [0,1,0,0,0,1|1,0,1]=4 316 B14R2.29365 Clc1ccc2c(c1)[nH]c(=O)[nH]c2=O PI-36141 [0,1,0,0,0,1|1,0,1]=4 317 B14R2.29365 Fc1ccc2c(c1)[nH]c(=O)[nH]c2=O PI-36137 [0,1,0,0,0,1|1,0,1]=4 318 B14R2.29365 Nc1ccc2c(c1)[nH]c(=O)[nH]c2=O PI-36043 [0,1,0,0,0,1|1,0,1]=4 319 B14R2.29365 O=C1NC2=C(C=CC(O)=C2)C(C)=C1 PI-37142 [0,1,0,0,0,1|2,0,0]=4 320 B14R2.450 OC(=O)c1cc2c(n1C)cccc2 PI-18229 [0,2,0,0,0,0|2,0,0]=4 321 B14R2.1129 C1=CC=C2C(=C1)N=C(N2CF)C=O PI-46461 [0,2,0,0,0,0|1,0,1]=4 322 B14R2.517 C1=CC=C2C(=C1)NC(=O)N2CCCl PI-34817 [0,2,0,0,0,0|1,0,0]=3 323 B14R2.642 CC(=C)N1C2=CC=CC=C2NC1=O PI-44859 [0,2,0,0,0,0|1,0,0]=3 324 B14R2.642 CC(=C)N1C2=CC=CC=C2NC1=O PI-45219 [0,2,0,0,0,0|1,0,0]=3 325 B14R2.19306 CCN1C2=CC=CC=C2C(=O)C1=O PI-50649 [0,2,0,0,0,0|1,0,1]=4 326 B14R2.645 C1=C2C(=CC(=C1F)Cl)NC(=O)C2=O PI-39893 [0,2,0,0,0,0|1,0,1]=4 327 B14R2.645 CC1=CC2=C(C=C1F)C(=O)C(=O)N2 PI-34494 [0,2,0,0,0,0|1,0,1]=4 328 B14R2.645 CC1=CC2=C(C=C1F)NC(=O)C2=O PI-34496 [0,2,0,0,0,0|1,0,1]=4 329 B14R2.645 O=C1Nc2cc(F)c(F)cc2C1=O PI-36131 [0,2,0,0,0,0|1,0,1]=4 330 B14R2.3274 COC1=CC2=C(C=C1)NC(=O)C2=O PI-29557 [0,2,0,0,0,0|1,0,1]=4 331 B14R2.4506 CC1=C(C2=C(C=C1)NC(=O)C2=O)Br PI-11531 [0,2,0,0,0,0|1,0,1]=4 332 B14R2.4506 O=C1NC2=C(C(Cl)=C(F)C=C2)C1=O PI-39891 [0,2,0,0,0,0|1,0,1]=4 333 B14R2.9184 CC1=CC(=CC2=C1NC(=O)C2=O)Cl PI-11533 [0,2,0,0,0,0|1,0,1]=4 334 B14R2.9184 CC1=CC2=C(C(=C1)F)NC(=O)C2=O PI-34498 [0,2,0,0,0,0|1,0,1]=4 335 B14R2.9184 ClC1=CC(Cl)=C2NC(=O)C(=O)C2=C1 PI-28708 [0,2,0,0,0,0|1,0,1]=4 336 B14R2.9184 O=C1NC2=C(C=C(Br)C=C2Br)C1=O PI-40285 [0,2,0,0,0,0|1,0,1]=4 337 B14R2.9184 O=C1NC2=C(C=C(F)C=C2C)C1=O PI-34495 [0,2,0,0,0,0|1,0,1]=4 338 B14R2.8620 C1=CC(=C2C(=C1Cl)C(=O)C(=O)N2)Cl PI-28235 [0,2,0,0,0,0|1,0,1]=4 339 B14R2.8620 C1=CC(=C2C(=C1F)C(=O)C(=O)N2)Br PI-42961 [0,2,0,0,0,0|1,0,1]=4 340 B14R2.8620 CC1=C2C(=C(C=C1)Br)C(=O)C(=O)N2 PI-11532 [0,2,0,0,0,0|1,0,1]=4 341 B14R2.8620 CC1=C2C(=C(C=C1)Cl)C(=O)C(=O)N2 PI-34469 [0,2,0,0,0,0|1,0,1]=4 342 B14R2.8620 CC1=C2C(=C(C=C1)F)C(=O)C(=O)N2 PI-34493 [0,2,0,0,0,0|1,0,1]=4 343 B14R2.8620 CC1=C2C(=C(C=C1)F)NC(=O)C2=O PI-34497 [0,2,0,0,0,0|1,0,1]=4 344 B14R2.8737 CC1=C(C2=C(C=C1)C(=O)C(=O)N2)F PI-34499 [0,2,0,0,0,0|1,0,1]=4 345 B14R2.8737 CC1=C(C2=C(C=C1)C(=O)C(=O)N2)F PI-35157 [0,2,0,0,0,0|1,0,1]=4 346 B14R2.8737 CC1=C(C=CC2=C1NC(=O)C2=O)F PI-34470 [0,2,0,0,0,0|1,0,1]=4 347 B14R2.11645 CCc1cccc2C(=O)C(=O)Nc12 PI-28927 [0,2,0,0,0,0|1,0,1]=4 348 B14R2.11645 COC1=CC=CC2=C1NC(=O)C2=O PI-44590 [0,2,0,0,0,0|1,0,1]=4 349 B14R2.27750 Fc1cc2NC(=O)C(=O)c2c(F)c1 PI-35978 [0,2,0,0,0,0|1,0,1]=4 350 B14R2.1815 COc1ccc2c(c1)NC(=O)C2=O PI-35970 [0,2,0,0,0,0|1,0,1]=4 351 B12R2.24 C1=CC2=CC(=O)NC=C2C=C1 PI-29911 [0,0,1,1,0,0|2,0,0]=4 352 B12R2.24 C1=CC=C2C(=C1)NC(=O)C=N2 PI-49857 [0,0,1,1,0,0|2,0,0]=4 353 B12R2.24 C1C(=O)NC2=CC=CC=C2N1 PI-50558 [0,0,1,1,0,0|2,0,0]=4 354 B12R2.24 O=C1CCc2c(N1)cccc2 PI-29698 [0,0,1,1,0,0|2,0,0]=4 355 B12R2.24 O=C1CSc2c(N1)cccc2 PI-14812 [0,0,1,1,0,0|1,1,0]=4 356 B12R2.315 C1=CC2=C(C(=C1)CO)NC=C2 PI-25039 [0,0,1,1,0,0|2,0,0]=4 357 B12R1.27 C1=CC=C(C=C1)CCC(=O)NN PI-50331 [0,0,1,0,0,1|2,0,0]=4 358 B12R1.27 C1=CC=C(C=C1)CNC(=O)CCl PI-49782 [0,0,1,0,0,1|2,0,0]=4 359 B12R1.27 C1=CC=C(C=C1)COC(=O)CO PI-48132 [0,0,1,0,0,1|2,0,0]=4 360 B12R1.27 C1=CC=C(C=C1)COC(=O)NN PI-13115 [0,0,1,0,0,1|2,0,0]=4 361 B12R1.27 C1=CC=C(C=C1)OCC(=O)NN PI-50252 [0,0,1,0,0,1|2,0,0]=4 362 B12R1.27 CNC(=S)NCC1=CC=CC=C1 PI-28336 [0,0,1,0,0,1|1,1,0]=4 363 B12R1.27 ONC(=O)OCc1ccccc1 PI-38635 [0,0,1,0,0,1|1,0,0]=3