0 B14R2.8188 CN1C(=O)C(Cl)=NC2=C1C=CC=C2 CS-0260703 [0,0,0,0,0,0|3,0,1]=4 1 B14R2.8188 CN1C(=O)C(N)CC2=CC=CC=C21 CS-0664711 [0,0,0,0,0,0|1,0,0]=1 2 B13R2.32 CC1CCC2=C(C=CC=C2)N1C CS-0513193 [1,0,0,0,0,0|2,0,1]=4 3 B13R2.32 CN1C(=O)NCC2=C1C=CC=C2 CS-0521460 [1,0,0,0,0,0|2,0,0]=3 4 B13R2.32 NC1CCC2=C(C=CC=C2)C1O CS-0043598 [1,0,0,0,0,0|2,0,1]=4 5 B13R2.32 O=C1C=CC2=CC=CC=C2N1O CS-0207308 [1,0,0,0,0,0|0,0,2]=3 6 B13R2.369 CC1C=C2C=CC=CC2=NC1=O CS-0309316 [1,0,0,0,0,0|1,0,2]=4 7 B13R2.369 CC1CC2=C(C=CC=C2)NC1C CS-0253161 [1,0,0,0,0,0|2,0,1]=4 8 B13R2.369 CC1NC2=C(N=CC=C2)NC1=O CS-0654691 [1,0,0,0,0,0|3,0,0]=4 9 B13R2.369 CC1OC2=NC=CC=C2NC1=O CS-0223922 [1,0,0,0,0,0|3,0,0]=4 10 B13R2.369 CC1SC2=CC=CC=C2NC1=O CS-0100720 [1,0,0,0,0,0|2,0,0]=3 11 B13R2.369 NC1CC2=C(C=CC=C2)CC1O CS-0076553 [1,0,0,0,0,0|1,0,2]=4 12 B13R2.369 NN1CC2=C(C=CC=C2)CC1=O CS-0835331 [1,0,0,0,0,0|2,0,0]=3 13 B13R2.369 O=C1NC2=C(C=CC=C2)C=C1Cl CS-0458830 [1,0,0,0,0,0|1,0,2]=4 14 B13R2.369 O=C1NC2=C(C=CC=C2)C=C1O CS-0064785 [1,0,0,0,0,0|1,0,2]=4 15 B13R2.369 O=C1NC2=CC=CC=C2CC1O CS-0060600 [1,0,0,0,0,0|1,0,0]=2 16 B15R2.13612 CC1OC2=C(N)C=CC=C2N(C)C1=O CS-0457527 [0,1,0,0,0,0|3,0,0]=4 17 B15R2.21243 CN1C(=O)C(NN)=NC2=CC=CC=C21 CS-0662431 [0,1,0,0,0,0|2,0,1]=4 18 B15R2.63893 CN1CC2=C(C=CC(N)=C2)N(C)C1=O CS-0050352 [0,1,0,0,0,0|3,0,0]=4 19 B15R2.136347 CN1C(=O)C(C)(C)NC2=CC=CC=C21 CS-0246389 [0,1,0,0,0,0|3,0,0]=4 20 B13R1.135 CC(OC1=CC=CC=C1)C(=O)NN CS-0314735 [0,0,1,0,0,0|3,0,0]=4 21 B13R1.135 CCC(=O)C(C)CC1=CC=CC=C1 CS-0235992 [0,0,1,0,0,0|3,0,0]=4 22 B13R1.135 CNC(=O)C(N)CC1=CC=CC=C1 CS-0098048 [0,0,1,0,0,0|1,0,0]=2 23 B13R1.135 CNC(=O)[C@H](N)CC1=CC=CC=C1 CS-0510480 [0,0,1,0,0,0|1,0,0]=2 24 B13R1.135 COC(=O)C(N)CC1=NC=CC=C1 CS-0231075 [0,0,1,0,0,0|3,0,0]=4 25 B13R1.135 COC(=O)[C@H](N)CC1=CC=CC=C1 CS-0010918 [0,0,1,0,0,0|2,0,0]=3 26 B13R1.135 NNC(=O)C(N)CC1=CC=CC=C1 CS-0960760 [0,0,1,0,0,0|1,0,0]=2 27 B13R1.696 CC1=CC=CC=C1N(C)C(=O)CN CS-0509172 [0,0,1,0,0,0|1,0,0]=2 28 B15R2.8448 CC1CC(=O)N(C)C2=CC=CC=C2N1 CS-0263154 [0,0,0,0,0,1|3,0,0]=4 29 B15R2.15770 CN1C(=O)C(N)CCC2=CC=CC=C21 CS-0078656 [0,0,0,0,0,1|1,0,0]=2 30 B15R2.15770 CN1C(=O)[C@@H](N)COC2=CC=CC=C21 CS-0099908 [0,0,0,0,0,1|1,0,0]=2 31 B12R1.371 CC1=C(NC(=O)CN)C=CC=C1 CS-0714718 [1,0,1,0,0,0|0,0,0]=2 32 B12R1.371 CC1=CC=CC=C1NC(=O)CBr CS-0213102 [1,0,1,0,0,0|1,0,0]=3 33 B12R1.371 O=C(CBr)NC1=CC=CC=C1Cl CS-0315845 [1,0,1,0,0,0|2,0,0]=4 34 B12R1.27 C#CC(=O)CCC1=CC=CC=C1 CS-0309380 [1,0,1,0,0,0|2,0,0]=4 35 B12R1.32 CNCC(N)CC1=CC=CC=C1 CS-0261429 [1,0,1,0,0,0|1,0,1]=4 36 B12R1.43 CC(C)C(=O)CC1=CC=CC=C1 CS-0273356 [1,0,1,0,0,0|2,0,0]=4 37 B12R1.43 CC(Cl)C(=O)CC1=CC=CC=C1 CS-0249883 [1,0,1,0,0,0|2,0,0]=4 38 B12R1.43 CC(N)C(=O)NC1=CC=CC=C1 CS-0684189 [1,0,1,0,0,0|0,0,0]=2 39 B12R1.43 CC(O)C(=O)CC1=CC=CC=C1 CS-0525099 [1,0,1,0,0,0|2,0,0]=4 40 B12R1.43 CC(OC1=CC=CC=C1)C(N)=O CS-0217354 [1,0,1,0,0,0|2,0,0]=4 41 B12R1.43 NC(=O)[C@H](N)CC1=CC=CC=C1 CS-0455201 [1,0,1,0,0,0|0,0,0]=2 42 B12R1.43 NC(CC1=CC=NC=C1)C(=O)O CS-0035623 [1,0,1,0,0,0|1,0,0]=3 43 B12R1.43 N[C@@H](CC1=CC=CN=C1)C(=O)O CS-W012822 [1,0,1,0,0,0|1,0,0]=3 44 B12R1.43 N[C@@H](CC1=NN=CC=C1)C(=O)O CS-0162643 [1,0,1,0,0,0|2,0,0]=4 45 B12R1.43 N[C@H](CC1=CC=CC=N1)C(=O)O CS-0671123 [1,0,1,0,0,0|1,0,0]=3 46 B12R1.43 N[C@H](CC1=CN=CC=C1)C(=O)O CS-0201636 [1,0,1,0,0,0|1,0,0]=3 47 B12R1.43 O=C(O)C(F)CC1=CC=CC=C1 CS-0232579 [1,0,1,0,0,0|1,0,0]=3 48 B12R1.43 O=C(O)C(S)CC1=CC=CC=C1 CS-0034529 [1,0,1,0,0,0|1,0,0]=3 49 B12R1.43 O=C(O)[C@H](Br)CC1=CC=CC=C1 CS-0312148 [1,0,1,0,0,0|1,0,0]=3 50 B12R1.34 CN(C(=O)CO)C1=CC=CC=C1 CS-0244843 [1,0,1,0,0,0|2,0,0]=4 51 B12R1.34 NNC(=O)[C@H](O)C1=CC=CC=C1 CS-0186128 [1,0,1,0,0,0|2,0,0]=4 52 B12R1.283 CCCC1=CC=CC=C1C(=O)O CS-0258613 [1,0,1,0,0,0|2,0,0]=4 53 B12R1.124 CC(=O)N(C)C1=CC=CC=C1N CS-0209107 [1,0,1,0,0,0|2,0,0]=4 54 B12R1.124 CC1=C(C(O)C(=O)O)C=CC=C1 CS-0701386 [1,0,1,0,0,0|2,0,0]=4 55 B12R2.24 NC1=NCC2=CC=CC=C2N1 CS-0671362 [2,0,0,0,0,0|2,0,0]=4 56 B12R2.24 N[C@@H]1COC2=C(C=CC=C2)C1 CS-W003915 [2,0,0,0,0,0|1,0,1]=4 57 B12R2.24 O=C1CNC2=CC=CC=C2O1 CS-0505646 [2,0,0,0,0,0|2,0,0]=4 58 B12R2.24 O=C1CNC2=CC=NC=C2N1 CS-0252301 [2,0,0,0,0,0|2,0,0]=4 59 B12R2.24 O=C1CSC2=C(C=NC=C2)N1 CS-0230130 [2,0,0,0,0,0|2,0,0]=4 60 B12R2.24 O=C1N=CC2=CC=CC=C2N1 CS-0085121 [2,0,0,0,0,0|1,0,1]=4 61 B12R2.24 O=C1NCC2=CC=CC=C2N1 CS-0149707 [2,0,0,0,0,0|1,0,0]=3 62 B12R2.24 O[C@@H]1CNC2=C(C=CC=C2)C1 CS-0053286 [2,0,0,0,0,0|1,0,1]=4 63 B12R2.24 O[C@H]1CNC2=C(C=CC=C2)C1 CS-0053347 [2,0,0,0,0,0|1,0,1]=4 64 B12R2.1081 NN1CCCC2=CC=CC=C21 CS-0662133 [2,0,0,0,0,0|1,0,1]=4 65 B14R1.3135 COC1=CC=CC=C1CC(N)C(=O)O CS-0464854 [0,1,1,0,0,0|2,0,0]=4 66 B14R1.60 CCNC(=O)C(N)CC1=CC=CC=C1 CS-0776753 [0,1,1,0,0,0|1,0,0]=3 67 B14R1.134 COC(=O)C(N)CC1=CC=C(O)C=C1 CS-0866007 [0,1,1,0,0,0|2,0,0]=4 68 B14R1.134 COC(=O)[C@@H](N)CC1=CC=C(Br)C=C1 CS-0479886 [0,1,1,0,0,0|2,0,0]=4 69 B14R1.134 COC(=O)[C@@H](N)CC1=CC=C(Cl)C=C1 CS-0110231 [0,1,1,0,0,0|2,0,0]=4 70 B14R1.134 COC(=O)[C@H](N)CC1=CC=C(Br)C=C1 CS-0506419 [0,1,1,0,0,0|2,0,0]=4 71 B14R1.135 COC(=O)C(N)CC1=CC=CC(F)=C1 CS-0781925 [0,1,1,0,0,0|2,0,0]=4 72 B14R1.425 CN(C)C(=O)C(N)CC1=CC=CC=C1 CS-0664017 [0,1,1,0,0,0|1,0,0]=3 73 B14R1.1007 COC(=O)C(N)CC1=CC=CC=C1O CS-0235522 [0,1,1,0,0,0|2,0,0]=4 74 B14R1.1007 COC(=O)[C@@H](N)CC1=CC=CC=C1C CS-0506551 [0,1,1,0,0,0|2,0,0]=4 75 B14R1.1007 COC(=O)[C@@H](N)CC1=CC=CC=C1Cl CS-0363189 [0,1,1,0,0,0|2,0,0]=4 76 B14R1.1107 COC(=O)C(C)(N)CC1=CC=CC=C1 CS-0119892 [0,1,1,0,0,0|2,0,0]=4 77 B14R1.132 CC(Br)C(=O)N(C)C1=CC=C(F)C=C1 CS-0334568 [0,1,1,0,0,0|2,0,0]=4 78 B14R1.243 CC1=CC=CC=C1N(C)C(=O)C(C)N CS-0506839 [0,1,1,0,0,0|1,0,0]=3 79 B14R1.3348 CCOC(=O)C(O)C1=CC=CC=C1C CS-0239748 [0,1,1,0,0,0|2,0,0]=4 80 B14R2.4513 CN1C(=O)CCC2=C1C=C(Br)C=C2 CS-0450806 [1,1,0,0,0,0|1,0,0]=3 81 B14R2.8038 CN1C(=O)NCC2=C(N)C=CC=C21 CS-0509021 [1,1,0,0,0,0|2,0,0]=4 82 B14R2.28523 CN1C(=O)COC2=CC=CC(N)=C21 CS-0463118 [1,1,0,0,0,0|2,0,0]=4 83 B14R2.29369 CN1C(=O)COC2=CC(Cl)=CC=C21 CS-0513575 [1,1,0,0,0,0|2,0,0]=4 84 B14R2.29369 CN1C(=O)NCC2=C1C=CC(Br)=C2 CS-0625255 [1,1,0,0,0,0|2,0,0]=4 85 B14R2.1019 CN1CC(CN)CC2=CC=CC=C21 CS-0300871 [1,1,0,0,0,0|1,0,1]=4 86 B14R2.1128 O=C1NC2=CC=CC=C2SC1CCl CS-0241788 [1,1,0,0,0,0|2,0,0]=4 87 B14R2.8239 CC1=CC2=C(C=C1)NC(=O)C(C)O2 CS-0491251 [1,1,0,0,0,0|2,0,0]=4 88 B14R2.8239 CC1OC2=C(C=CC(N)=C2)NC1=O CS-0440625 [1,1,0,0,0,0|2,0,0]=4 89 B14R2.8239 CC1OC2=CC=C(F)C=C2NC1=O CS-0458061 [1,1,0,0,0,0|2,0,0]=4 90 B14R2.28472 CC1OC2=CC=CC(N)=C2NC1=O CS-0441592 [1,1,0,0,0,0|2,0,0]=4 91 B14R2.28472 CN1CC2=CC=CC(N)=C2NC1=O CS-0745165 [1,1,0,0,0,0|2,0,0]=4 92 B14R2.8716 CN1C(=O)C(N)C2=C1C=CC(Br)=C2 CS-0259407 [0,1,0,0,1,0|1,0,0]=3 93 B14R2.28485 CC1=CC=CC2=C1N(C)C(=O)C2N CS-0695972 [0,1,0,0,1,0|1,0,0]=3 94 B14R2.57380 CN1C(=O)C(C)(C)C2=CC=CC=C21 CS-0464691 [0,1,0,0,1,0|2,0,0]=4 95 B14R2.972 NNC(=O)C1CC2=CC=CC=C2O1 CS-0252641 [0,0,1,1,0,0|2,0,0]=4 96 B14R2.4514 CC1C(=O)NCC1C2=CC=CC=C2 CS-0669755 [0,0,1,1,0,0|2,0,0]=4 97 B14R2.279 NC1C(=O)NCCC2=C1C=CC=C2 CS-0696935 [0,0,1,1,0,0|2,0,0]=4 98 B14R2.279 NC1C(=O)NCCC2=CC=CC=C21 CS-0333454 [0,0,1,1,0,0|2,0,0]=4 99 B14R2.1199 CC1=C2C(=CC=C1)N=C(CN)N2C CS-0221785 [0,0,1,1,0,0|2,0,0]=4 100 B12R2.18 CC1C(=O)CC2=C1C=CC=C2 CS-0221920 [1,0,0,0,1,0|2,0,0]=4 101 B12R2.18 CN1C(=O)CC2=C1C=NC=C2 CS-0504725 [1,0,0,0,1,0|2,0,0]=4 102 B12R2.18 CN1C(=O)OC2=CC=CC=C21 CS-0006684 [1,0,0,0,1,0|2,0,0]=4 103 B12R2.18 O=C1NC2=C(C=CC=C2)C1O CS-0253475 [1,0,0,0,1,0|2,0,0]=4 104 B14R1.743 COC(=O)CC(N)CC1=CC=CC=C1 CS-0439635 [0,0,1,0,0,1|2,0,0]=4 105 B14R1.743 COC(=O)C[C@H](N)CC1=CC=CC=C1 CS-0699079 [0,0,1,0,0,1|2,0,0]=4 106 B14R1.756 COC(=O)[C@@H](N)CCC1=CC=CC=C1 CS-0509763 [0,0,1,0,0,1|2,0,0]=4 107 B14R1.417 CC(C)OC(=O)C(O)C1=CC=CC=C1 CS-0166145 [0,0,1,0,0,1|2,0,0]=4