0 B13R2.435 CC(C)C1=CC2=C(C=CC=C2)N1 78635 [0,0,0,0,0,0|2,0,1]=3 1 B13R2.435 O=C(O)C1=CC2=CN=CN=C2S1 D72860 [0,0,0,0,0,0|3,0,0]=3 2 B13R2.435 O=C(O)C1=NC2=C(C=NC=C2)S1 CS1872 [0,0,0,0,0,0|2,0,1]=3 3 B13R2.435 O=C(O)C1=NC2=CC=CN=C2S1 P12275 [0,0,0,0,0,0|2,0,1]=3 4 B13R2.435 O=C(O)[C@H]1CC2=C(C1)N=CC=C2 AT25950 [0,0,0,0,0,0|2,0,2]=4 5 B13R2.435 OB(O)C1=CC2=C(C=CN=C2)S1 D74401 [0,0,0,0,0,0|3,0,1]=4 6 B13R2.435 OB(O)C1=CC2=C(N=CC=C2)N1 P19338 [0,0,0,0,0,0|2,0,1]=3 7 B13R2.435 OB(O)C1=NC2=C(C=CC=C2)S1 F16784 [0,0,0,0,0,0|2,0,2]=4 8 B12R2.32 C#CC1=CC2=C(C=CC=C2)N1 AT21565 [1,0,0,0,0,0|1,0,1]=3 9 B12R2.32 N#CC1=CC2=C(C=CC=N2)N1 74484 [1,0,0,0,0,0|2,0,1]=4 10 B12R2.32 NCC1=CC2=CC=CN=C2N1 D74741 [1,0,0,0,0,0|2,0,1]=4 11 B12R2.32 NCC1=CC2=NC=CC=C2N1 D74743 [1,0,0,0,0,0|2,0,1]=4 12 B12R2.32 O=CC1=CC2=C(N=CC=C2)O1 AT21739 [1,0,0,0,0,0|2,0,0]=3 13 B12R2.32 O=CC1=CC2=CN=CN=C2S1 D72791 [1,0,0,0,0,0|3,0,0]=4 14 B12R2.32 O=CC1=CN2N=CC=CC2=C1 98463 [1,0,0,0,0,0|3,0,0]=4 15 B12R2.32 OCC1=CC2=C(C=CN=C2)S1 D74277 [1,0,0,0,0,0|2,0,1]=4 16 B14R2.450 CN1C(C(=O)Cl)=CC2=C1C=CC=C2 24453 [0,1,0,0,0,0|1,0,0]=2 17 B14R2.450 CN1C(C(=O)O)=CC2=C1N=CN=C2 P13436 [0,1,0,0,0,0|2,0,0]=3 18 B14R2.450 O=[N+]([O-])C1=C(Br)C2=C(C=CC=C2)S1 D72930 [0,1,0,0,0,0|2,0,1]=4 19 B14R2.972 CNC(=O)C1=NN2C=CC=CC2=C1 D77828 [0,1,0,0,0,0|2,0,1]=4 20 B14R2.972 COC(=O)C1=NC2=C(C=CN=C2)N1 87411 [0,1,0,0,0,0|2,0,0]=3 21 B14R2.3129 O=S(=O)(Cl)C1=NC2=C(C=CC=C2)N1 28291 [0,1,0,0,0,0|2,0,1]=4 22 B14R2.4529 CC(=O)C1=CC2=C(C=C(Br)C=C2)O1 D73260 [0,1,0,0,0,0|2,0,0]=3 23 B14R2.4529 CC(=O)C1=CC2=C(C=C(C)C=C2)O1 D73256 [0,1,0,0,0,0|2,0,0]=3 24 B14R2.4529 CC(=O)C1=CC2=C(C=C(F)C=C2)O1 D73263 [0,1,0,0,0,0|2,0,0]=3 25 B14R2.4529 CC(=O)C1=CC2=C(C=CC(N)=C2)O1 D73255 [0,1,0,0,0,0|2,0,0]=3 26 B14R2.4529 CC1=CC2=CC(C(=O)O)=NN2C=C1 AT24779 [0,1,0,0,0,0|1,0,1]=3 27 B14R2.4529 NC1=NC2=C(C=N1)C=C(C(=O)O)N2 P14411 [0,1,0,0,0,0|2,0,0]=3 28 B14R2.4529 NC1=NC=C2C=C(C(=O)O)SC2=N1 D72795 [0,1,0,0,0,0|3,0,0]=4 29 B14R2.4529 O=C(O)C1=CC2=C(C=CC(I)=C2)N1 AT23463 [0,1,0,0,0,0|0,0,0]=1 30 B14R2.4529 O=C(O)C1=CN2C=C(Cl)C=CC2=C1 AT23554 [0,1,0,0,0,0|2,0,0]=3 31 B14R2.4529 O=C(O)C1=CN2C=C(F)C=CC2=C1 AT23553 [0,1,0,0,0,0|2,0,0]=3 32 B14R2.4529 O=C(O)C1=NC2=C(C=C(Br)C=C2)O1 D82375 [0,1,0,0,0,0|1,0,1]=3 33 B14R2.4529 O=C(O)C1=NC2=NC=C(Br)C=C2O1 AT23169 [0,1,0,0,0,0|2,0,1]=4 34 B14R2.4529 O=C(O)C1=NN2C=CC(Cl)=NC2=C1 AT10329 [0,1,0,0,0,0|2,0,1]=4 35 B14R2.4529 O=C(O)[C@@H]1CC2=C(C=CC(F)=C2)O1 D86147 [0,1,0,0,0,0|1,0,2]=4 36 B14R2.4529 OB(O)C1=CC2=C(C=CC(F)=C2)S1 D72692 [0,1,0,0,0,0|2,0,1]=4 37 B14R2.7969 CC(=O)C1=CC2=CC=CC(F)=C2O1 D73264 [0,1,0,0,0,0|2,0,0]=3 38 B14R2.7969 CC(=O)C1=NC2=CC=CC(Br)=C2N1 AT16458 [0,1,0,0,0,0|2,0,0]=3 39 B14R2.7969 CC(=O)C1=NC2=CC=CC(Br)=C2S1 AT14633 [0,1,0,0,0,0|2,0,1]=4 40 B14R2.7969 O=C(O)C1=CC2=C(N=NC=C2O)N1 94924 [0,1,0,0,0,0|2,0,0]=3 41 B14R2.7969 O=C(O)C1=CC2=C(N=NN=C2O)N1 94932 [0,1,0,0,0,0|3,0,0]=4 42 B14R2.7969 O=C(O)C1=CC2=C(NC=NC2=O)S1 D76975 [0,1,0,0,0,0|3,0,0]=4 43 B14R2.7969 O=C(O)C1=CN2C=CC=C(F)C2=C1 AT23552 [0,1,0,0,0,0|2,0,0]=3 44 B14R2.7969 O=C(O)C1=NC2=C(Cl)C=CN=C2N1 P17653 [0,1,0,0,0,0|2,0,0]=3 45 B14R2.7969 O=C(O)[C@H]1CC2=CC=CC(Br)=C2C1 AT10112 [0,1,0,0,0,0|1,0,2]=4 46 B14R2.7969 OB(O)C1=CC2=CC=CC(Cl)=C2S1 89383 [0,1,0,0,0,0|2,0,1]=4 47 B12R1.43 N[13C@@H](CC1=CC=CC=C1)C(=O)O D98682 [0,0,1,0,0,0|0,0,2]=3 48 B12R2.252 O=C(O)C1=CC2=C(NC=C2)N1 D75949 [0,0,0,0,1,0|1,0,0]=2 49 B12R2.3190 CC(=O)[C@@H]1CC2=C1C=CC=C2 E72984 [0,0,0,0,1,0|1,0,2]=4 50 B12R2.3190 O=C(Cl)[C@@H]1CC2=C1C=CC=C2 E73149 [0,0,0,0,1,0|1,0,2]=4 51 B14R2.781 O=C(O)C1=CC2=C(C=CC=C2)CC1 AT23526 [0,0,0,0,0,1|1,0,0]=2 52 B14R2.781 O=C(O)C1=CC2=CC=NN=C2C=C1 F30688 [0,0,0,0,0,1|3,0,0]=4 53 B14R2.781 O=C(O)C1=NC2=CC=CC=C2C=N1 C16002 [0,0,0,0,0,1|0,0,1]=2 54 B14R2.781 O=C(O)[C@@H]1COC2=C(C=CC=C2)N1 F12435 [0,0,0,0,0,1|0,0,2]=3 55 B13R1.148 CC1=CC=CC(CC(=O)C(=O)O)=C1 C92166 [0,1,1,0,0,0|1,0,1]=4 56 B13R1.152 C[C@@H](C1=CC=CC=C1)[C@H](N)C(=O)O AT21380 [0,1,1,0,0,0|0,0,2]=4 57 B13R1.152 C[C@@H](C1=CC=CC=C1)[C@H](N)C(=O)O AT21393 [0,1,1,0,0,0|0,0,2]=4 58 B13R1.152 C[C@H](C1=CC=CC=C1)[C@H](N)C(=O)O AT10108 [0,1,1,0,0,0|0,0,2]=4 59 B13R1.202 CC1=C(CC(=O)C(=O)O)C=CC=C1 C92179 [0,1,1,0,0,0|1,0,1]=4 60 B13R1.202 O=C(O)C(=O)CC1=C(F)C=CC=C1 C91157 [0,1,1,0,0,0|1,0,1]=4 61 B13R2.43 O=CC1=CC2=CC(Cl)=NC=C2N1 D78883 [1,1,0,0,0,0|1,0,0]=3 62 B13R2.43 O=CC1=CC2=CC(Cl)=NC=C2S1 AT10712 [1,1,0,0,0,0|2,0,0]=4 63 B13R2.45 O=CC1=C(I)C2=C(C=CC=C2)N1 W19263 [1,1,0,0,0,0|0,0,0]=2 64 B13R2.54 O=CC1=CC2=C(C=CNC2=O)S1 AT16641 [1,1,0,0,0,0|2,0,0]=4 65 B13R2.54 O=CC1=CC2=CN=CC(F)=C2N1 P20168 [1,1,0,0,0,0|1,0,0]=3 66 B13R2.400 O=C(O)C1=CC2=C(N1)SC(Cl)=C2 L10084 [0,1,0,0,1,0|1,0,0]=3 67 B13R2.531 COC(=O)C1=CC2=C(NC=C2)N1 D75948 [0,1,0,0,1,0|1,0,0]=3 68 B13R2.4852 O=C(O)[C@@H]1CC2=C(Cl)C=CC=C21 AT20395 [0,1,0,0,1,0|0,0,2]=4 69 B13R2.4854 O=C(O)[C@@H]1CC2=CC=CC(Cl)=C21 AT20393 [0,1,0,0,1,0|0,0,2]=4 70 B13R2.4930 CC1=CC2=C(C=C1)C[C@H]2C(=O)O E73127 [0,1,0,0,1,0|0,0,2]=4 71 B13R2.4930 O=C(O)[C@@H]1CC2=C1C=C(Cl)C=C2 AT20396 [0,1,0,0,1,0|0,0,2]=4 72 B15R2.629 O=C(O)CC1=C(F)C2=C(C=CC=C2)O1 95405 [0,1,0,0,0,1|1,0,0]=3 73 B15R2.4244 N[C@@H](C(=O)O)C1=CC2=C(C=CC=C2)O1 59850 [0,1,0,0,0,1|1,0,0]=3 74 B15R2.7252 O=C(O)CC1=CC2=C(C=CC(Cl)=C2)N1 AC8854 [0,1,0,0,0,1|0,0,0]=2 75 B15R2.984 CC1=CC2=CC=CC=C2C=C1C(=O)O AT24781 [0,1,0,0,0,1|1,0,0]=3 76 B15R2.984 CC1=CC2=CC=CC=C2N=C1C(=O)O 71783 [0,1,0,0,0,1|0,0,1]=3 77 B15R2.984 O=C(O)C1=CC2=CC=CC=C2C=C1Br AT24783 [0,1,0,0,0,1|1,0,0]=3 78 B15R2.984 O=C(O)C1=CC2=CC=CN=C2C=C1O K10311 [0,1,0,0,0,1|2,0,0]=4 79 B15R2.1601 COC(=O)C1=CC2=CC=NC=C2N=C1 70997 [0,1,0,0,0,1|1,0,1]=4 80 B15R2.1601 COC(=O)[C@@H]1CCC2=C(C=CC=C2)N1 69679 [0,1,0,0,0,1|0,0,2]=4 81 B15R2.7174 CC1=CC=C2C=CC(C(=O)O)=CC2=N1 AT21929 [0,1,0,0,0,1|2,0,0]=4 82 B15R2.7174 NC(=O)C1=CN=C2C=CC(F)=CC2=C1 87218 [0,1,0,0,0,1|1,0,1]=4 83 B15R2.7174 NC1=CC=C2C=CC(C(=O)O)=NC2=C1 82804 [0,1,0,0,0,1|0,0,1]=3 84 B15R2.7174 NC1=CC=C2N=CC(C(=O)O)=CC2=N1 K10122 [0,1,0,0,0,1|1,0,1]=4 85 B15R2.7174 O=C(O)C1=CC=C2C=NC(F)=CC2=C1 87629 [0,1,0,0,0,1|2,0,0]=4 86 B15R2.7174 O=C(O)C1=CC=C2C=NC(F)=CC2=N1 F51353 [0,1,0,0,0,1|1,0,1]=4 87 B15R2.7174 O=C(O)C1=CC=C2N=CC(Cl)=CC2=C1 AT22001 [0,1,0,0,0,1|2,0,0]=4 88 B15R2.7174 O=C(O)C1=CC=C2N=CC(I)=CC2=C1 AT22004 [0,1,0,0,0,1|2,0,0]=4 89 B15R2.7174 O=C(O)[C@@H]1CC2=C(C=CC(Br)=C2)CN1 AT18818 [0,1,0,0,0,1|0,0,2]=4 90 B15R2.7174 O=C(O)[C@@H]1CC2=C(C=CC(Br)=C2)CN1 AT18820 [0,1,0,0,0,1|0,0,2]=4 91 B15R2.7174 O=C(O)[C@@H]1CC2=C(C=CC(Cl)=C2)CN1 AT18817 [0,1,0,0,0,1|0,0,2]=4 92 B15R2.7174 O=C(O)[C@@H]1CC2=C(C=CC(F)=C2)CN1 AT18815 [0,1,0,0,0,1|0,0,2]=4 93 B15R2.7180 CC1=CN=C2C=C(C(=O)O)C=CC2=C1 K10221 [0,1,0,0,0,1|2,0,0]=4 94 B15R2.7180 NC1=CN=C2C=C(C(=O)O)C=NC2=C1 K10245 [0,1,0,0,0,1|1,0,1]=4 95 B15R2.7180 O=C(O)C1=CC2=C(C=C(Br)C=C2)OC1 AT10586 [0,1,0,0,0,1|1,0,0]=3 96 B15R2.7180 O=C(O)C1=CC2=CC=C(O)C=C2C=N1 D75675 [0,1,0,0,0,1|0,0,1]=3 97 B15R2.7180 O=C(O)C1=CC=C2C=C(Cl)N=CC2=C1 D74333 [0,1,0,0,0,1|2,0,0]=4 98 B15R2.7180 O=C(O)C1=CC=C2C=C(F)C=NC2=C1 73644 [0,1,0,0,0,1|2,0,0]=4 99 B15R2.7180 O=C(O)C1=CC=C2C=C([18F])C=CC2=C1 C92409 [0,1,0,0,0,1|1,0,0]=3 100 B15R2.7180 O=C(O)C1=CN=C2C=C(Cl)N=CC2=C1 AT22564 [0,1,0,0,0,1|1,0,1]=4 101 B15R2.7180 O=C(O)C1=CN=C2C=C(F)C=NC2=C1 AT22576 [0,1,0,0,0,1|1,0,1]=4 102 B15R2.7180 O=C(O)C1=CN=C2N=C(Cl)C=CC2=C1 AT22566 [0,1,0,0,0,1|1,0,1]=4 103 B15R2.7180 O=C(O)C1=NC=C2C=C(Cl)C=NC2=C1 P18146 [0,1,0,0,0,1|1,0,1]=4 104 B15R2.13598 NC1=C2C=CC(C(=O)O)=CC2=CC=N1 AT23565 [0,1,0,0,0,1|2,0,0]=4 105 B15R2.13598 NC1=C2N=CC(C(=O)O)=CC2=NC=C1 K10097 [0,1,0,0,0,1|1,0,1]=4 106 B15R2.13598 NC1=C2N=CC(C(=O)O)=CC2=NC=C1 K10231 [0,1,0,0,0,1|1,0,1]=4 107 B15R2.13598 O=C(O)C1=CC=C2C(=C1)C=CN=C2Br K10286 [0,1,0,0,0,1|2,0,0]=4 108 B15R2.13598 O=C(O)C1=CC=C2C(=C1)C=CN=C2Br K10304 [0,1,0,0,0,1|2,0,0]=4 109 B15R2.13598 O=C(O)C1=CC=C2C(Br)=CC=NC2=C1 F30560 [0,1,0,0,0,1|2,0,0]=4 110 B15R2.13598 O=C(O)C1=CN=C2C(Br)=CC=NC2=C1 K10098 [0,1,0,0,0,1|1,0,1]=4 111 B15R2.13598 O=C(O)C1=CN=C2C(Br)=CC=NC2=C1 K10232 [0,1,0,0,0,1|1,0,1]=4 112 B15R2.13598 O=C(O)C1=CN=C2C(Br)=CN=CC2=C1 K10127 [0,1,0,0,0,1|1,0,1]=4 113 B15R2.13598 O=C(O)C1=CN=C2C(Br)=CN=CC2=C1 K10244 [0,1,0,0,0,1|1,0,1]=4 114 B15R2.13598 O=C(O)C1=CN=C2C(Cl)=CC=NC2=C1 K10233 [0,1,0,0,0,1|1,0,1]=4 115 B15R2.13598 O=C(O)C1=NC=C2C(Br)=CC=CC2=C1 AT26749 [0,1,0,0,0,1|0,0,1]=3 116 B15R2.14951 O=C(O)C1=CC2=CC=NC=C2C(F)=C1 D87187 [0,1,0,0,0,1|2,0,0]=4 117 B15R2.14951 O=C(O)C1=CC2=NC=CC=C2C(F)=C1 K10282 [0,1,0,0,0,1|2,0,0]=4 118 B15R2.14951 O=C(O)C1=CC2=NC=CC=C2C(F)=C1 K10302 [0,1,0,0,0,1|2,0,0]=4 119 B15R2.61353 CC1=C2C=C(C(=O)O)C=CC2=NC=C1 D86120 [0,1,0,0,0,1|2,0,0]=4 120 B15R2.61353 NC1=C2C=C(C(=O)O)C=CC2=CN=C1 K10064 [0,1,0,0,0,1|2,0,0]=4 121 B15R2.61353 NC1=C2C=C(C(=O)O)C=CC2=CN=C1 K10225 [0,1,0,0,0,1|2,0,0]=4 122 B15R2.61353 O=C(O)C1=CC=C2C=CC=C(Br)C2=C1 AT10615 [0,1,0,0,0,1|1,0,0]=3 123 B15R2.61353 O=C(O)C1=NC=C2C=CC=C(Cl)C2=C1 79238 [0,1,0,0,0,1|0,0,1]=3 124 B15R2.61353 O=C(O)[C@@H]1CC2=C(Br)C=CC=C2CN1 AT24877 [0,1,0,0,0,1|0,0,2]=4 125 B15R2.61353 O=C(O)[C@@H]1CC2=C(Br)C=CC=C2CN1 AT24878 [0,1,0,0,0,1|0,0,2]=4 126 B15R2.4190 N#CC1=C2C=CC=CN2C=C1C(=O)O AT23550 [0,2,0,0,0,0|2,0,0]=4 127 B15R2.14758 NC1=C(C(=O)O)SC2=NC(F)=CC=C21 AT10598 [0,2,0,0,0,0|2,0,0]=4 128 B15R2.1356 CCOC(=O)C1=CC2=C(N=CN=C2)N1 P19320 [0,2,0,0,0,0|2,0,0]=4 129 B15R2.1590 COC(=O)C1=CC2=C(C=CC(I)=C2)N1 AT23475 [0,2,0,0,0,0|0,0,0]=2 130 B15R2.1590 COC(=O)C1=CC2=CC(Cl)=NC=C2S1 AT18806 [0,2,0,0,0,0|2,0,0]=4 131 B15R2.1590 COC(=O)C1=CC2=CN=C(Br)C=C2N1 P14470 [0,2,0,0,0,0|1,0,0]=3 132 B15R2.1590 COC(=O)C1=CN2C=C(Br)C=CC2=C1 55176 [0,2,0,0,0,0|2,0,0]=4 133 B15R2.1590 COC(=O)C1=NC2=C(C=C(N)C=C2)S1 AC8338 [0,2,0,0,0,0|1,0,1]=4 134 B15R2.1590 COC(=O)C1=NC2=C(C=CC(Br)=N2)N1 O11947 [0,2,0,0,0,0|2,0,0]=4 135 B15R2.1590 COC(=O)C1=NC2=C(C=CC(F)=C2)N1 AT11075 [0,2,0,0,0,0|1,0,0]=3 136 B15R2.1598 COC(=O)C1=CC2=C(Br)C=CN=C2N1 P11014 [0,2,0,0,0,0|1,0,0]=3 137 B15R2.1598 COC(=O)C1=CC2=C(N=NC=C2O)N1 94923 [0,2,0,0,0,0|2,0,0]=4 138 B15R2.1598 COC(=O)C1=NC2=C(Br)C=CC=C2N1 AT11074 [0,2,0,0,0,0|1,0,0]=3 139 B15R2.1598 COC(=O)C1=NC2=C(F)C=CC=C2N1 AT11068 [0,2,0,0,0,0|1,0,0]=3 140 B15R2.1102 CC(=O)C1=CC2=C(C=C(C)C(C)=C2)O1 D73239 [0,2,0,0,0,0|2,0,0]=4 141 B15R2.1102 O=C(O)C1=CC2=CC(Cl)=C(Cl)C=C2N1 D85427 [0,2,0,0,0,0|0,0,0]=2 142 B15R2.1102 O=C(O)C1=CC2=CC(F)=C(Cl)C=C2N1 AT10575 [0,2,0,0,0,0|0,0,0]=2 143 B15R2.1102 O=C(O)C1=CN2C=C(F)C(Cl)=CC2=C1 AT23555 [0,2,0,0,0,0|2,0,0]=4 144 B15R2.1102 O=C(O)C1=NC2=CC(F)=C(F)C=C2N1 AT11082 [0,2,0,0,0,0|1,0,0]=3 145 B15R2.4834 C#CC1=CC2=C(C=C1)NC(C(=O)O)=C2 AT24680 [0,2,0,0,0,0|0,0,0]=2 146 B15R2.4834 COC1=CC2=C(N=C1)NC(C(=O)O)=C2 E73092 [0,2,0,0,0,0|1,0,0]=3 147 B15R2.7254 CC1=C(C)C2=C(C=C1)C=C(C(=O)O)N2 D86679 [0,2,0,0,0,0|0,0,0]=2 148 B15R2.7254 O=C(O)C1=CC2=C(C=CC(F)=C2Cl)N1 AT10571 [0,2,0,0,0,0|0,0,0]=2 149 B15R2.7254 O=C(O)C1=CC2=C(C=CC(F)=C2F)O1 P17976 [0,2,0,0,0,0|1,0,0]=3 150 B15R2.7254 O=C(O)C1=CC2=C(N1)C(F)=C(Br)C=C2 AT24673 [0,2,0,0,0,0|0,0,0]=2 151 B15R2.7254 O=C(O)C1=CC2=C(N1)C(F)=C(F)C=C2 AT24672 [0,2,0,0,0,0|0,0,0]=2 152 B15R2.15633 CC1=CC2=C(C=C(C(=O)O)N2)C(C)=C1 D86678 [0,2,0,0,0,0|0,0,0]=2 153 B15R2.15633 O=C(O)C1=CC2=CC(Cl)=CC(F)=C2N1 P10232 [0,2,0,0,0,0|0,0,0]=2 154 B15R2.15633 O=C(O)C1=CC2=NC(Cl)=NC(Cl)=C2N1 P18695 [0,2,0,0,0,0|2,0,0]=4 155 B15R2.14566 CC1=C2C=C(C(=O)O)NC2=C(F)C=C1 AT24669 [0,2,0,0,0,0|0,0,0]=2 156 B15R2.14566 O=C(O)C1=CC2=C(Br)C=CC(F)=C2N1 AT24671 [0,2,0,0,0,0|0,0,0]=2 157 B15R2.14566 O=C(O)C1=CC2=C(Cl)C=CC(F)=C2N1 AT24668 [0,2,0,0,0,0|0,0,0]=2 158 B15R2.20824 C#CC1=CC=CC2=C1C=C(C(=O)O)N2 AT24682 [0,2,0,0,0,0|0,0,0]=2 159 B13R2.369 CC1=CC2=CC=CC=C2C=C1N D88160 [0,0,1,1,0,0|2,0,0]=4 160 B13R2.369 NC1=CC2=C(C=CC=C2)NC1=O AC9491 [0,0,1,1,0,0|1,0,0]=3 161 B13R2.5179 CC1=C2C=CC(O)=CC2=CC=C1 N14584 [0,0,1,1,0,0|2,0,0]=4 162 B13R2.5179 NC1=C2C=CC(F)=CC2=CC=C1 AT23037 [0,0,1,1,0,0|2,0,0]=4 163 B13R2.5179 NC1=C2C=CC(F)=CC2=CC=C1 F53478 [0,0,1,1,0,0|2,0,0]=4 164 B13R2.5179 NC1=C2C=CC(F)=NC2=CC=C1 E70239 [0,0,1,1,0,0|2,0,0]=4 165 B13R2.5179 OC1=CC=C2C(F)=CC=CC2=N1 D71270 [0,0,1,1,0,0|2,0,0]=4 166 B13R2.72 O=C(O)C1=NN=C2C=CC=CN21 92437 [0,0,1,1,0,0|2,0,0]=4 167 B13R2.430 O=C(O)C1=CC2=C(C=CS2)C=N1 D74404 [0,0,1,1,0,0|1,0,1]=4 168 B13R2.430 O=C(O)C1=CN2C=CC=C2C=C1 C75753 [0,0,1,1,0,0|2,0,0]=4 169 B13R2.430 O=C(O)C1=NC2=C(C=C1)OC=C2 AT24847 [0,0,1,1,0,0|1,0,1]=4 170 B13R2.430 O=C(O)C1=NC=C2C=CNC2=C1 27673 [0,0,1,1,0,0|1,0,1]=4 171 B13R2.430 O=C(O)C1=NC=C2C=COC2=C1 D73588 [0,0,1,1,0,0|1,0,1]=4 172 B11R1.36 N[C@@H](C(=O)O)C1=CC=NC=C1 AT23446 [0,0,1,0,1,0|1,0,1]=4 173 B11R1.36 N[C@@H](C(=O)O)C1=CC=NC=C1 AT23447 [0,0,1,0,1,0|1,0,1]=4 174 B11R2.15 O=CC1=CC2=C(C=CS2)N1 AT18505 [1,0,0,0,1,0|1,0,0]=3 175 B11R2.15 OCC1=CC2=C(C=CS2)N1 AT18504 [1,0,0,0,1,0|1,0,1]=4 176 B13R1.351 O=C(O)C(=O)OCC1=CC=CC=C1 D76053 [0,0,1,0,0,1|1,0,1]=4 177 B13R2.57 O=CC1=CC2=NC=CC=C2N=C1 N10034 [1,0,0,0,0,1|1,0,1]=4 178 B15R2.1668 O=C(O)C[C@@H]1CNC2=C(C=CC=C2)C1 97930 [0,0,0,0,0,2|0,0,2]=4 179 B15R2.1668 O=C(O)C[C@H]1CCC2=C(C=CC=C2)N1 97922 [0,0,0,0,0,2|0,0,2]=4 180 B15R2.1668 O=C(O)C[C@H]1CSC2=C(C=CC=C2)N1 97924 [0,0,0,0,0,2|0,0,2]=4