0 B15R2.984 CC(=O)C1=C(C)N=C2C=CN=CC2=C1 4995AE [0,0,0,0,0,0|4,0,0]=4 1 B15R2.984 CC(=O)C1=CC2=C(C=CN=C2)NC1=O 4994AE [0,0,0,0,0,0|3,0,0]=3 2 B15R2.984 CC1=C(C(=O)O)C=C2C=CC=NC2=N1 X3128 [0,0,0,0,0,0|3,0,0]=3 3 B15R2.984 O=C([O-])C1=CC2=C(C=CC=C2)C=C1O 5918AF [0,0,0,0,0,0|1,0,2]=3 4 B15R2.984 OB(O)C1=C(Br)N=C2C=CC=CC2=C1 1587AC [0,0,0,0,0,0|3,0,1]=4 5 B15R2.984 OB(O)C1=C(Cl)N=C2C=CC=CC2=C1 V1902 [0,0,0,0,0,0|3,0,1]=4 6 B14R2.781 CC(=O)C1=CC=C2C=CC=CC2=N1 0341AA [1,0,0,0,0,0|3,0,0]=4 7 B14R2.781 CC(=O)C1=NC=C2C=CC=CC2=C1 5399AC [1,0,0,0,0,0|3,0,0]=4 8 B14R2.781 NC(=O)C1=CC=C2C=NC=CC2=C1 4167AJ [1,0,0,0,0,0|3,0,0]=4 9 B14R2.781 NC(=S)C1=CC2=C(C=CC=C2)OC1 Y9082 [1,0,0,0,0,0|1,1,1]=4 10 B14R2.781 O=C(O)C1=CC2=CC=NC=C2N=C1 9649AH [1,0,0,0,0,0|2,0,0]=3 11 B14R2.781 O=C(O)C1=CC2=CN=CC=C2C=C1 Y5348 [1,0,0,0,0,0|2,0,0]=3 12 B14R2.781 O=C(O)C1=CC2=CN=CN=C2C=C1 0413AC [1,0,0,0,0,0|3,0,0]=4 13 B14R2.781 O=C(O)C1=CC2=NC=CC=C2N=C1 V8914 [1,0,0,0,0,0|2,0,0]=3 14 B14R2.781 O=C(O)C1=CC=C2OCC=CC2=C1 7461AB [1,0,0,0,0,0|2,0,1]=4 15 B14R2.781 O=C(O)C1=CN=C2N=CC=CC2=C1 1079AA [1,0,0,0,0,0|2,0,0]=3 16 B14R2.781 O=C(O)C1=CN=C2N=CC=NC2=C1 2280AF [1,0,0,0,0,0|3,0,0]=4 17 B14R2.781 O=C(O)C1=NC2=C(C=CC=N2)C=C1 0957AB [1,0,0,0,0,0|3,0,0]=4 18 B14R2.1128 CC1OC2=C(C=CC=C2)C=C1C=O 5909AE [1,0,0,0,0,0|1,0,1]=3 19 B14R2.1128 N#CC1=CC2=CC=CC=C2NC1=O 4697AB [1,0,0,0,0,0|2,0,1]=4 20 B14R2.1128 O=CC1=NC2=CC=CC=C2N=C1Cl 2252AJ [1,0,0,0,0,0|3,0,0]=4 21 B16R2.23361 CC1(C(=O)O)OC2=CC=CC=C2NC1=O 4824AD [0,1,0,0,0,0|2,0,1]=4 22 B16R2.23372 CC(=O)C1=C(C)C2=C(C=CC=C2)N=C1C 7553AJ [0,1,0,0,0,0|3,0,0]=4 23 B16R2.23372 CC(=O)C1=C(O)C2=C(C=CC=C2)NC1=O Z4514 [0,1,0,0,0,0|2,0,0]=3 24 B16R2.23372 CC1=C(C(=O)O)C(C)=C2C=CC=CC2=N1 Z2449 [0,1,0,0,0,0|2,0,0]=3 25 B16R2.23372 O=C(O)C1=C(O)C2=CC=CC=C2NC1=O 9017AE [0,1,0,0,0,0|1,0,0]=2 26 B16R2.23520 CC(=O)C1=CC2=C(C=C(C)C=C2)OC1=O 6839AD [0,1,0,0,0,0|1,0,0]=2 27 B16R2.23520 CC(=O)C1=CC2=C(C=C(O)C=C2)OC1=O 0991AA [0,1,0,0,0,0|1,0,0]=2 28 B16R2.23520 CC1=C(C(=O)O)C=C2C=CC(F)=CC2=N1 V8565 [0,1,0,0,0,0|2,0,0]=3 29 B16R2.23521 CC1=C(C(=O)O)C=C2C=C(Cl)C=CC2=N1 V9183 [0,1,0,0,0,0|2,0,0]=3 30 B16R2.23521 CC1=NC2=C(C=C(F)C=C2)C=C1C(=O)O 3990AE [0,1,0,0,0,0|2,0,0]=3 31 B16R2.33941 COC(=O)C1=CC2=C(C=CC=C2)N=C1N 1709AC [0,1,0,0,0,0|2,0,0]=3 32 B16R2.83668 CN1C(=O)C(C(=O)O)=NC2=CC=CC=C21 6230AD [0,1,0,0,0,0|2,0,0]=3 33 B16R2.126889 CC1=CC=CC2=C1N=C(C)C(C(=O)O)=C2 2271AE [0,1,0,0,0,0|2,0,0]=3 34 B16R2.126889 O=C(O)C1=CC2=CC=CC(O)=C2C=C1O 5919AF [0,1,0,0,0,0|1,0,1]=3 35 B14R2.450 CC(=O)C1=C(Br)C2=C(C=CC=C2)O1 4717AF [0,0,0,0,1,0|3,0,0]=4 36 B14R2.450 CC(=O)C1=C(C)C2=CC=CC=C2S1 6310AD [0,0,0,0,1,0|3,0,0]=4 37 B14R2.450 NC(=O)C1=C(Cl)C2=CC=CC=C2S1 Y8230 [0,0,0,0,1,0|3,0,0]=4 38 B14R2.450 O=C(O)C1=C(Br)C2=CC=CC=C2S1 0811AQ [0,0,0,0,1,0|2,0,0]=3 39 B14R2.450 O=C(O)C1=C(Br)N2C=CC=CC2=N1 4423AB [0,0,0,0,1,0|3,0,0]=4 40 B14R2.450 O=C(O)C1=C(Cl)C2=CC=CC=C2N1 9185AD [0,0,0,0,1,0|2,0,0]=3 41 B14R2.624 O=C(O)C1=CC2=C(C=C1Cl)NC=C2 Y8463 [0,0,0,0,1,0|3,0,0]=4 42 B14R2.642 CC(=O)N1C(=O)OC2=CC=CC=C21 L468 [0,0,0,0,1,0|2,0,0]=3 43 B16R2.3989 O=C(O)CC1=CC2=C(C=CC=C2)OC1=O 7097AD [0,0,0,0,0,1|0,0,0]=1 44 B13R1.90 COC1=C(\C=C\C(=O)Cl)C=CC=C1 5001AD [1,0,1,0,0,0|1,0,1]=4 45 B13R1.202 CC1=CC=CC=C1NC(=O)C(=O)O 2766AE [1,0,1,0,0,0|2,0,0]=4 46 B13R2.57 O=CC1=CC2=C(C=CC=N2)N=C1 4506AF [2,0,0,0,0,0|2,0,0]=4 47 B13R2.57 O=CC1=CC2=CN=CC=C2C=C1 W8938 [2,0,0,0,0,0|2,0,0]=4 48 B13R2.57 O=CC1=CC=C2C=NC=CC2=C1 Y5303 [2,0,0,0,0,0|2,0,0]=4 49 B13R2.369 O=C1NC2=CC=CC=C2C=C1Br 6011AC [2,0,0,0,0,0|2,0,0]=4 50 B13R2.369 O=C1NC2=CC=CC=C2C=C1Cl 6012AC [2,0,0,0,0,0|2,0,0]=4 51 B13R2.369 O=C1NC2=CC=CC=C2C=C1O 8747AD [2,0,0,0,0,0|1,0,0]=3 52 B13R2.369 O=C1OC2=C(C=CC=C2)N=C1O 1581AE [2,0,0,0,0,0|1,0,0]=3 53 B13R2.369 OC1=CC2=CC=CC=C2N=C1Cl 5432AA [2,0,0,0,0,0|2,0,0]=4 54 B15R1.5914 CC(=O)OC1=C(\C=C\C(=O)O)C=CC=C1 1950AL [0,1,1,0,0,0|0,0,0]=2 55 B15R1.7062 CCOC1=C(C=CC(=O)O)C=C(Br)C=C1 5681AD [0,1,1,0,0,0|1,0,1]=4 56 B15R2.627 NC1=C(C(=O)O)C=NC2=CC=CC=C21 Y9812 [1,1,0,0,0,0|1,0,0]=3 57 B15R2.627 O=C(O)C1=C(Cl)C2=CC=CC=C2N=C1 Y8028 [1,1,0,0,0,0|1,0,0]=3 58 B15R2.627 O=C(O)C1=C(O)C2=NC=CC=C2N=C1 7622AB [1,1,0,0,0,0|2,0,0]=4 59 B15R2.1601 CCC(=O)C1=CC2=C(C=CC=C2)C=C1 9940AH [1,1,0,0,0,0|2,0,0]=4 60 B15R2.1601 COC(=O)C1=CN=C2C=CC=NC2=C1 3332AD [1,1,0,0,0,0|2,0,0]=4 61 B15R2.1601 NCC(=O)C1=CC2=C(C=CC=C2)C=C1 2045AE [1,1,0,0,0,0|2,0,0]=4 62 B15R2.7174 O=C(O)C1=CC2=CC(Br)=CC=C2OC1 2044AE [1,1,0,0,0,0|0,0,1]=3 63 B15R2.7174 O=C(O)C1=CC2=CC(F)=CC=C2N=C1 3026AL [1,1,0,0,0,0|1,0,0]=3 64 B15R2.7174 O=C(O)C1=CC=C2C=CC(Br)=CC2=C1 3671AJ [1,1,0,0,0,0|1,0,0]=3 65 B15R2.7180 CC(=O)C1=CC2=C(C=C1)C=C(N)C=C2 X3575 [1,1,0,0,0,0|2,0,0]=4 66 B15R2.7180 CC(=O)C1=CC=C2C=C(O)C=CC2=C1 0992AA [1,1,0,0,0,0|2,0,0]=4 67 B15R2.7180 O=C(O)C1=CC2=CC=C(Br)C=C2N=C1 Y5826 [1,1,0,0,0,0|1,0,0]=3 68 B15R2.7180 O=C1C=CC2=C(C=CC(C(=O)O)=C2)N1 0944AC [1,1,0,0,0,0|2,0,0]=4 69 B15R2.13598 CC1=C2N=CC(C(=O)O)=CC2=CC=C1 3100AL [1,1,0,0,0,0|1,0,0]=3 70 B15R2.13598 O=C(O)C1=CC2=C(C=C1)C(=O)C=CN2 6291AC [1,1,0,0,0,0|2,0,0]=4 71 B15R2.13598 O=C(O)C1=CC2=CC=CC(Cl)=C2N=C1 1020AC [1,1,0,0,0,0|1,0,0]=3 72 B15R2.13598 O=C(O)C1=CC2=NC=CC(O)=C2C=C1 Z3905 [1,1,0,0,0,0|2,0,0]=4 73 B15R2.13598 O=C(O)C1=CN=C2C(Br)=CC=CC2=C1 W5633 [1,1,0,0,0,0|1,0,0]=3 74 B15R2.14951 NC1=C2C=CC=CC2=NC(C(=O)O)=C1 7924AA [1,1,0,0,0,0|2,0,0]=4 75 B15R2.14951 O=C(O)C1=CC2=C(C=CC=C2)C(=O)N1 5154AJ [1,1,0,0,0,0|2,0,0]=4 76 B15R2.14951 O=C(O)C1=NC2=CC=CC=C2C(Br)=C1 0685AB [1,1,0,0,0,0|2,0,0]=4 77 B15R2.61353 O=C(O)C1=CC2=C(Br)C=CC=C2OC1 1826AF [1,1,0,0,0,0|0,0,1]=3 78 B15R2.61353 O=C(O)C1=CC2=C(C=CN=C2O)C=C1 5533AA [1,1,0,0,0,0|2,0,0]=4 79 B15R2.274 O=CC1=C(Cl)C2=CC=CC=C2OC1=O 6898AB [1,1,0,0,0,0|0,0,0]=2 80 B15R2.888 O=C1NC2=CC=CC=C2C=C1\C=N\O 5765AE [1,1,0,0,0,0|1,0,0]=3 81 B15R2.888 O\N=C\C1=C(Cl)N=C2C=CC=CC2=C1 3547AF [1,1,0,0,0,0|2,0,0]=4 82 B15R2.1754 CC1=CC2=C(C=C1)C=C(C=O)C(=O)N2 9945AE [1,1,0,0,0,0|1,0,0]=3 83 B15R2.1824 CC1=CC2=C(C=C1)NC(=O)C(C=O)=C2 0372AA [1,1,0,0,0,0|1,0,0]=3 84 B15R2.2039 CC1=C2N=C(O)C(C=O)=CC2=CC=C1 5064AH [1,1,0,0,0,0|1,0,1]=4 85 B15R2.2039 O=CC1=C(Cl)N=C2C(Cl)=CC=CC2=C1 W3160 [1,1,0,0,0,0|2,0,0]=4 86 B15R2.21243 CN1C(=O)C(C=O)=CC2=C1C=CC=C2 X6346 [1,1,0,0,0,0|1,0,0]=3 87 B15R2.21243 CN1C(=O)C(CO)=CC2=CC=CC=C21 9495AC [1,1,0,0,0,0|1,0,1]=4 88 B15R2.1592 COC(=O)C1=C(Br)C2=C(C=CC=C2)N1 W4554 [0,1,0,0,1,0|2,0,0]=4 89 B15R2.1592 COC(=O)C1=C(C)C2=CC=CC=C2O1 0626AB [0,1,0,0,1,0|2,0,0]=4 90 B15R2.1592 COC(=O)C1=C(Cl)C2=CC=CC=C2S1 Y8229 [0,1,0,0,1,0|2,0,0]=4 91 B15R2.1592 COC(=O)C1=C(I)C2=C(C=CC=C2)N1 V6463 [0,1,0,0,1,0|2,0,0]=4 92 B15R2.1592 COC(=O)C1=C(N)C2=C(C=CC=C2)N1 4282AD [0,1,0,0,1,0|2,0,0]=4 93 B15R2.1592 COC(=O)C1=C(O)C2=CC=CC=C2S1 Y7396 [0,1,0,0,1,0|1,0,1]=4 94 B15R2.1592 COC(=O)C1CC2=CC=CC=C2C1=O Y1826 [0,1,0,0,1,0|0,0,2]=4 95 B15R2.4190 O=CC1=C(C(=O)O)NC2=CC=CC=C21 9186AD [0,1,0,0,1,0|1,0,0]=3 96 B15R2.7203 CC1=C(C(=O)O)NC2=C1C=C(Cl)C=C2 5258AD [0,1,0,0,1,0|2,0,0]=4 97 B15R2.7203 CC1=C(C(=O)O)NC2=CC=C(Br)C=C21 8384AE [0,1,0,0,1,0|2,0,0]=4 98 B15R2.7203 CC1=C(C(=O)O)OC2=C1C=C(F)C=C2 0109AF [0,1,0,0,1,0|2,0,0]=4 99 B15R2.7203 CC1=CC=C2C=C(C(=O)O)N(C)C2=C1 2284AF [0,1,0,0,1,0|2,0,0]=4 100 B15R2.7203 O=C(O)C1=C(Br)C2=C(C=CC(Br)=C2)N1 4630AF [0,1,0,0,1,0|2,0,0]=4 101 B15R2.9921 CC1=C(C(=O)O)N(C)C2=CC=CC=C21 6932AD [0,1,0,0,1,0|2,0,0]=4 102 B15R2.9921 CN1C2=C(C=CC=C2)C(Br)=C1C(=O)O 4323AE [0,1,0,0,1,0|2,0,0]=4 103 B15R2.13463 CC1=C(C(=O)O)NC2=C(Cl)C=CC=C12 5259AD [0,1,0,0,1,0|2,0,0]=4 104 B15R2.13463 CC1=C2C=C(C(=O)O)N(C)C2=CC=C1 8092AD [0,1,0,0,1,0|2,0,0]=4 105 B15R2.13463 CC1=C2OC(C(=O)O)=C(C)C2=CC=C1 5405AD [0,1,0,0,1,0|2,0,0]=4 106 B15R2.13463 CN1C(C(=O)O)=CC2=C(Cl)C=CC=C21 8091AD [0,1,0,0,1,0|2,0,0]=4 107 B15R2.13629 CC1=C2C(=CC=C1)C=C(C(=O)O)N2C 0872AF [0,1,0,0,1,0|2,0,0]=4 108 B15R2.13629 CC1=CC=CC2=C1C(Cl)=C(C(=O)O)S2 3287AF [0,1,0,0,1,0|2,0,0]=4 109 B15R2.13629 CN1C(C(=O)O)=CC2=CC=CC(Cl)=C21 8471AC [0,1,0,0,1,0|2,0,0]=4 110 B15R2.13629 O=C(O)C1=C(Cl)C2=C(C=CC=C2Br)S1 3420AF [0,1,0,0,1,0|2,0,0]=4 111 B15R2.13629 O=C(O)C1=C(Cl)C2=C(C=CC=C2Cl)S1 1010AE [0,1,0,0,1,0|2,0,0]=4 112 B15R2.14758 CN1C(C(=O)O)=CC2=CC(Br)=CC=C21 2806AF [0,1,0,0,1,0|2,0,0]=4 113 B15R2.14758 NC1=C(C(=O)O)SC2=C1C=CC(Br)=C2 Y2466 [0,1,0,0,1,0|2,0,0]=4 114 B15R2.1853 CCC1=C(C(C)=O)C2=CC=CC=C2O1 5888AB [0,1,0,0,1,0|2,0,0]=4 115 B15R2.7204 CC1=C(C(=O)O)C2=C(C=CC(O)=C2)N1 1171AC [0,1,0,0,1,0|2,0,0]=4 116 B15R2.19393 COC(=O)C1=C(C)NC2=C1C=CC=C2 3822AH [0,1,0,0,1,0|2,0,0]=4 117 B15R2.19393 COC(=O)C1=C(Cl)NC2=C1C=CC=C2 7670AA [0,1,0,0,1,0|2,0,0]=4 118 B15R2.19393 O=C(CCl)N1C(=O)OC2=C1C=CC=C2 4472AF [0,1,0,0,1,0|2,0,0]=4 119 B17R2.39114 CC1=C(CC(=O)O)C(C)=C2C=CC=CC2=N1 Z2363 [0,1,0,0,0,1|2,0,0]=4 120 B17R2.58574 CCC(=O)C1=C(O)C2=C(C=CC=C2)OC1=O 2928AE [0,2,0,0,0,0|1,0,0]=3 121 B17R2.64947 COC1=CC2=NC(C)=C(C(=O)O)C=C2C=C1 4062AE [0,2,0,0,0,0|2,0,0]=4 122 B17R2.64948 COC1=CC2=C(C=C1)NC(=O)C(C(=O)O)=C2 7748AA [0,2,0,0,0,0|1,0,0]=3 123 B17R2.64948 COC1=CC2=C(C=C1)OC(=O)C(C(=O)O)=C2 3040AL [0,2,0,0,0,0|0,0,0]=2 124 B17R2.64948 COC1=CC2=CC(C(=O)O)=C(C)N=C2C=C1 2063AF [0,2,0,0,0,0|2,0,0]=4 125 B17R2.880639 CC(=O)C1=CC2=C(OC1=O)C(Cl)=CC(Cl)=C2 Y8306 [0,2,0,0,0,0|1,0,0]=3 126 B17R2.880639 CC1=CC(C)=C2N=C(C)C(C(=O)O)=CC2=C1 1371AF [0,2,0,0,0,0|2,0,0]=4 127 B17R2.880639 O=C(O)C1=CC2=C(OC1=O)C(Br)=CC(Br)=C2 Y8950 [0,2,0,0,0,0|0,0,0]=2 128 B17R2.50008 CCOC(=O)C1=CC2=C(C=CC=C2)NC1=O X6893 [0,2,0,0,0,0|1,0,0]=3 129 B17R2.392577 COC1=CC=CC2=C1OC(=O)C(C(=O)O)=C2 8486AD [0,2,0,0,0,0|0,0,0]=2 130 B17R2.392577 COC1=CC=CC2=C1OC(=O)C(C(=O)O)C2 8011AJ [0,2,0,0,0,0|0,0,2]=4 131 B17R3.31564 NC1=C2C(=O)OC3=C(C=CC=C3)C2=CS1 2871AE [0,1,0,1,0,0|1,1,0]=4 132 B13R2.72 CC(=O)C1=COC2=CC=CC=C21 7685AE [1,0,0,0,1,0|1,0,0]=3 133 B13R2.430 O=C(O)C1=CN=C2C=COC2=C1 Z8614 [1,0,0,0,1,0|2,0,0]=4 134 B13R2.435 NC(=O)C1=CC2=CC=CC=C2S1 7065AE [1,0,0,0,1,0|1,1,0]=4 135 B13R2.435 NC(=O)C1=NC2=C(C=CC=C2)O1 1563AJ [1,0,0,0,1,0|2,0,0]=4 136 B13R2.435 O=C(O)C1=CC2=C(C=CC=C2)C1 5744AB [1,0,0,0,1,0|0,0,1]=3 137 B13R2.435 O=C(O)C1=CC2=C(C=NC=C2)O1 8940AC [1,0,0,0,1,0|1,0,0]=3 138 B13R2.435 O=C(O)C1=CN2N=CC=CC2=C1 3094AA [1,0,0,0,1,0|2,0,0]=4 139 B13R2.435 O=C(O)C1OC2=CC=CC=C2O1 0228AF [1,0,0,0,1,0|1,0,1]=4 140 B13R2.435 O=C([O-])C1=NC2=CC=CC=C2O1 7649AH [1,0,0,0,1,0|1,0,1]=4 141 B13R2.45 O=C1C2=C(C=CC=C2)C\C1=N/O V3441 [1,0,0,0,1,0|1,0,1]=4 142 B13R2.45 O=CC1=C(Br)C2=CC=CC=C2S1 0373AQ [1,0,0,0,1,0|2,0,0]=4 143 B13R2.45 O=CC1=C(Cl)C2=CC=CC=C2S1 Z5457 [1,0,0,0,1,0|2,0,0]=4 144 B13R2.135 CC1=C(C=O)C2=C(C=CC=C2)O1 5577AE [1,0,0,0,1,0|1,0,0]=3 145 B15R1.3569 O=C(O)C(=NNC1=CC=CC=C1)C(=O)O 5582AB [0,0,1,0,0,1|1,0,0]=3 146 B15R2.988 O=C1C=C(C(=O)O)C2=CC=CC=C2N1 0769AQ [0,0,0,0,1,1|1,0,0]=3 147 B15R2.988 O=C1CC(C(=O)O)C2=CC=CC=C2N1 4230AD [0,0,0,0,1,1|1,0,1]=4 148 B15R2.988 O=C1N=C(C(=O)O)C2=C(C=CC=C2)N1 6939AC [0,0,0,0,1,1|1,0,0]=3