0 B13R1.718 COC(=O)CNCC1=CC=CC=C1 SC-73836 [0,0,0,0,0,0|3,0,0]=3 1 B12R1.252 O=C(Cl)CCCC1=CC=CC=C1 SC-71520 [1,0,0,0,0,0|2,0,0]=3 2 B12R1.252 O=C(Cl)COCC1=CC=CC=C1 SC-20864 [1,0,0,0,0,0|3,0,0]=4 3 B12R1.252 O=C(O)CCCC1=CC=CC=C1 SC-22740 [1,0,0,0,0,0|2,0,0]=3 4 B12R1.252 O=C(O)CNCC1=CC=CC=C1 SC-24828 [1,0,0,0,0,0|3,0,0]=4 5 B12R1.252 O=C(O)COCC1=CC=CC=C1 SC-11831 [1,0,0,0,0,0|3,0,0]=4 6 B14R1.520 CCOC(=O)CCNC1=NC=CC=C1 SC-44413 [0,1,0,0,0,0|3,0,0]=4 7 B14R1.520 CCOC(=O)CNCC1=CC=CC=C1 SC-12695 [0,1,0,0,0,0|2,0,0]=3 8 B14R1.520 CCOC(=O)COCC1=CC=CC=C1 SC-68827 [0,1,0,0,0,0|2,0,0]=3 9 B14R1.520 CCOC(=O)C\N=C\C1=CC=CC=C1 SC-31188 [0,1,0,0,0,0|2,0,1]=4 10 B14R1.743 COC(=O)CC(=O)CC1=CC=CC=C1 SC-25807 [0,1,0,0,0,0|2,0,1]=4 11 B14R1.6449 C=C(C)C(=O)OCCC1=CC=CC=C1 SC-A3302 [0,1,0,0,0,0|0,0,1]=2 12 B14R2.19 O=C1CCN(CC2=CC=CC=C2)C1 SC-06753 [0,0,0,1,0,0|2,0,0]=3 13 B14R2.19 O=C1N[C@H](CC2=CC=CC=C2)CO1 SC-00097 [0,0,0,1,0,0|2,0,0]=3 14 B14R2.19 S=C1N[C@@H](CC2=CC=CC=C2)CS1 SC-17059 [0,0,0,1,0,0|2,1,0]=4 15 B14R2.19 S=C1N[C@H](CC2=CC=CC=C2)CS1 SC-75768 [0,0,0,1,0,0|2,1,0]=4 16 B14R2.19 [C@H]1(CC2=CC=CC=C2)COC(=O)N1 SC-07268 [0,0,0,1,0,0|2,0,0]=3 17 B14R2.68 O=C1CCC(C2=CC=CC=C2)CC1 SC-51008 [0,0,0,1,0,0|1,0,0]=2 18 B12R1.27 C#CC(=O)OCC1=CC=CC=C1 SC-36441 [0,0,0,0,1,0|0,0,2]=3 19 B12R1.27 C=CC(=O)OCC1=CC=CC=C1 SC-21489 [0,0,0,0,1,0|0,0,2]=3 20 B12R1.27 COC(=O)CCC1=CC=CC=C1 SC-15551 [0,0,0,0,1,0|1,0,0]=2 21 B12R1.27 COC(=O)COC1=CC=CC=C1 SC-95721 [0,0,0,0,1,0|2,0,0]=3 22 B12R1.27 NCC(=O)OCC1=CC=CC=C1 SC-12034 [0,0,0,0,1,0|1,0,0]=2 23 B12R1.27 NCC(=O)OCC1=CC=CC=C1 SC-21071 [0,0,0,0,1,0|1,0,0]=2 24 B12R1.27 NNC(=O)CCC1=CC=NC=C1 SC-40186 [0,0,0,0,1,0|3,0,0]=4 25 B12R1.27 NNC(=O)OCC1=CC=CC=C1 SC-13650 [0,0,0,0,1,0|2,0,0]=3 26 B12R1.27 O=C(CBr)OCC1=CC=CC=C1 SC-05223 [0,0,0,0,1,0|1,0,0]=2 27 B12R1.27 O=C(CCl)NCC1=CC=CC=C1 SC-54022 [0,0,0,0,1,0|2,0,0]=3 28 B12R1.27 O=C(CCl)OCC1=CC=CC=C1 SC-25618 [0,0,0,0,1,0|1,0,0]=2 29 B12R1.27 O=C(CO)OCC1=CC=CC=C1 SC-A2141 [0,0,0,0,1,0|1,0,0]=2 30 B12R1.27 O=C(NO)OCC1=CC=CC=C1 SC-31135 [0,0,0,0,1,0|2,0,0]=3 31 B14R1.716 COC(=O)CCNCC1=CC=CC=C1 SC-71276 [0,0,0,0,0,1|2,0,0]=3 32 B11R1.28 BrCCCCC1=CC=CC=C1 SC-13820 [2,0,0,0,0,0|1,0,1]=4 33 B11R1.28 BrCCOCC1=CC=CC=C1 SC-57855 [2,0,0,0,0,0|1,0,1]=4 34 B11R1.28 CCCNCC1=CC=CC=C1 SC-65059 [2,0,0,0,0,0|1,0,1]=4 35 B11R1.28 ClCCOCC1=CC=CC=C1 SC-12134 [2,0,0,0,0,0|1,0,1]=4 36 B11R1.28 ICCOCC1=CC=CC=C1 SC-A2944 [2,0,0,0,0,0|1,0,1]=4 37 B11R1.28 O=CCCCC1=CC=CC=C1 SC-59796 [2,0,0,0,0,0|1,0,0]=3 38 B11R1.28 O=CCOCC1=CC=CC=C1 SC-47403 [2,0,0,0,0,0|2,0,0]=4 39 B11R1.28 OCCCCC1=CC=CC=C1 SC-03572 [2,0,0,0,0,0|1,0,1]=4 40 B11R1.28 OCCOCC1=CC=CC=C1 SC-05822 [2,0,0,0,0,0|1,0,1]=4 41 B13R1.28 BrCCCCCCC1=CC=CC=C1 SC-54175 [1,1,0,0,0,0|1,0,1]=4 42 B13R1.42 CCCC(=O)CCC1=CC=CC=C1 SC-75929 [1,1,0,0,0,0|1,0,1]=4 43 B13R1.42 CCOC(=O)CCC1=CC=CC=C1 SC-25957 [1,1,0,0,0,0|2,0,0]=4 44 B13R1.158 O=C(O)CCCC1=CC=CC=C1F SC-11471 [1,1,0,0,0,0|2,0,0]=4 45 B13R1.348 NC(CC(=O)O)CC1=CC=CC=C1 SC-46101 [1,1,0,0,0,0|2,0,0]=4 46 B13R1.348 N[C@@H](CC(=O)O)CC1=CC=CC=C1 SC-48872 [1,1,0,0,0,0|2,0,0]=4 47 B13R1.348 N[C@@H](CC(=O)O)CC1=CC=CC=C1 SC-77068 [1,1,0,0,0,0|2,0,0]=4 48 B13R1.348 N[C@H](CC(=O)O)CC1=CC=CC=C1 SC-46102 [1,1,0,0,0,0|2,0,0]=4 49 B13R1.351 CC(=O)C(=O)OCC1=CC=CC=C1 SC-A3376 [1,1,0,0,0,0|2,0,0]=4 50 B13R1.351 NC(CCC1=CC=CC=C1)C(=O)O SC-10977 [1,1,0,0,0,0|2,0,0]=4 51 B13R1.351 N[C@@H](CCC1=CC=CC=C1)C(=O)O SC-10979 [1,1,0,0,0,0|2,0,0]=4 52 B13R1.351 N[C@@H](CCC1=CC=CC=C1)C(=O)O SC-78855 [1,1,0,0,0,0|2,0,0]=4 53 B13R1.351 O=C(O)[C@H](O)CCC1=CC=CC=C1 SC-44640 [1,1,0,0,0,0|2,0,0]=4 54 B13R1.351 [C@@H](N)(CCC1=CC=CC=C1)C(=O)O SC-10978 [1,1,0,0,0,0|2,0,0]=4 55 B13R1.513 CC(=O)NCCC1=CC=C(O)C=C1 SC-83302 [1,1,0,0,0,0|1,0,0]=3 56 B13R1.513 CC1=CC=C(CCCC(=O)O)C=C1 SC-68300 [1,1,0,0,0,0|2,0,0]=4 57 B13R1.513 O=C(O)CCCC1=CC=C(Br)C=C1 SC-49268 [1,1,0,0,0,0|2,0,0]=4 58 B13R1.11 COC(=O)C[C@H](N)C1=CC=CC=C1 SC-A3407 [0,1,0,0,1,0|1,0,0]=3 59 B13R1.14 COC(=O)CCC1=CC=C(Br)C=C1 SC-26053 [0,1,0,0,1,0|1,0,0]=3 60 B13R1.14 COC(=O)CNC1=CC=C(O)C=C1 SC-10466 [0,1,0,0,1,0|2,0,0]=4 61 B13R1.14 COC(=O)CNC1=CC=C(O)C=C1 SC-47943 [0,1,0,0,1,0|2,0,0]=4 62 B13R1.15 COC(=O)CCC1=CC=CC(O)=C1 SC-73789 [0,1,0,0,1,0|1,0,0]=3 63 B13R1.135 C=C(CC1=CC=CC=C1)C(=O)OC SC-27010 [0,1,0,0,1,0|1,0,1]=4 64 B13R1.135 [C@@H](N)(CC1=CC=CC=C1)C(=O)OC SC-09795 [0,1,0,0,1,0|1,0,0]=3 65 B13R1.417 CCN(CC)CCC1=CC=CC=C1 SC-66377 [0,1,0,0,1,0|2,0,0]=4 66 B13R1.717 CCC(=O)OCCC1=NC(C)=CS1 SC-B0100 [0,1,0,0,1,0|2,0,0]=4 67 B15R1.778 CCOC(=O)CCNCC1=CC=CC=C1 SC-22758 [0,1,0,0,0,1|1,0,0]=3 68 B15R1.959 COC(=O)CCCC(=O)C1=CC=CC=C1 SC-02694 [0,1,0,0,0,1|2,0,0]=4 69 B15R1.1321 COC(=O)C(N)COCC1=CC=CC=C1 SC-58181 [0,1,0,0,0,1|2,0,0]=4 70 B15R1.1321 COC(=O)C(N)COCC1=CC=CC=C1 SC-59771 [0,1,0,0,0,1|2,0,0]=4 71 B15R1.809 CCOC(=O)CC(=O)CC1=CC=CC=C1 SC-12294 [0,2,0,0,0,0|1,0,1]=4 72 B15R1.826 CCOC(=O)C(=O)CCC1=CC=CC=C1 SC-25887 [0,2,0,0,0,0|1,0,0]=3 73 B15R1.826 CCOC(=O)[C@H](O)CCC1=CC=CC=C1 SC-07249 [0,2,0,0,0,0|1,0,0]=3 74 B13R2.3 C1=CC=C(C2CCCNC2)C=C1 SC-81796 [1,0,0,1,0,0|1,0,1]=4 75 B13R2.3 C1=CC=C(C2CCNCC2)C=C1 SC-06733 [1,0,0,1,0,0|2,0,0]=4 76 B13R2.3 C1=CC=C([C@@H]2CCCNC2)C=C1 SC-24124 [1,0,0,1,0,0|1,0,1]=4 77 B13R2.64 C1=CC=C(CC2CCCN2)C=C1 SC-78431 [1,0,0,1,0,0|1,0,1]=4 78 B13R2.10 O=C1CC(C2=CC=CC=C2)CN1 SC-A2649 [1,0,0,1,0,0|1,0,0]=3 79 B13R2.10 O=C1N[C@@H](C2=CC=CC=C2)CO1 SC-07544 [1,0,0,1,0,0|1,0,0]=3 80 B13R2.10 O=C1N[C@H](C2=CC=CC=C2)CO1 SC-07250 [1,0,0,1,0,0|1,0,0]=3 81 B13R2.72 CC(=O)N1CCC2=C1C=CC=C2 SC-01460 [1,0,0,1,0,0|1,0,0]=3 82 B13R2.72 O=C(O)C1CCC2=C1C=CC=C2 SC-21633 [1,0,0,1,0,0|2,0,0]=4 83 B13R2.163 O=C1CC2=CC=CC=C2CCN1 SC-A3624 [1,0,0,1,0,0|1,0,0]=3 84 B13R2.163 O=C1CCCC2=CC=CC=C2C1 SC-48284 [1,0,0,1,0,0|1,0,0]=3 85 B13R2.163 O=C1NCCC2=CC=CC=C2N1 SC-49030 [1,0,0,1,0,0|2,0,0]=4 86 B13R2.423 O=C(O)C1CC1C2=CC=CC=C2 SC-71542 [1,0,0,1,0,0|2,0,0]=4 87 B13R2.423 O=C(O)[C@@H]1C[C@H]1C2=CC=CC=C2 SC-52795 [1,0,0,1,0,0|2,0,0]=4 88 B13R2.32 CC1C(=O)CCC2=C1C=CC=C2 SC-88952 [0,0,0,1,1,0|0,0,0]=2 89 B13R2.32 CC1C2=C(C=CC=C2)CCC1N SC-88939 [0,0,0,1,1,0|1,0,1]=4 90 B13R2.33 O=C1CCC2=CC=CC=C2CC1 SC-66203 [0,0,0,1,1,0|0,0,0]=2 91 B15R2.29 O=C1CCN(CC2=CC=CC=C2)CC1 SC-03828 [0,0,0,1,0,1|1,0,0]=3 92 B15R2.79765 COC(=O)C1CNCC2=C1C=CC=C2 SC-35191 [0,0,0,1,0,1|2,0,0]=4 93 B15R2.98 NC1=CC=C(C[C@H]2COC(=O)N2)C=C1 SC-46085 [0,1,0,1,0,0|2,0,0]=4 94 B15R2.31 O=C1CCCN(CC2=CC=CC=C2)C1 SC-04247 [0,1,0,1,0,0|2,0,0]=4 95 B15R2.31 O=C1CCCN(CC2=CC=CC=C2)C1 SC-04894 [0,1,0,1,0,0|2,0,0]=4 96 B15R2.31 O=C1CN(CC2=CC=CC=C2)CCO1 SC-A4771 [0,1,0,1,0,0|2,0,0]=4 97 B15R2.314 CC1CN(CC2=CC=CC=C2)CC1=O SC-A3686 [0,1,0,1,0,0|2,0,0]=4 98 B15R2.1601 COC(=O)C1CCC2=C(C=CC=C2)C1 SC-90141 [0,1,0,1,0,0|2,0,0]=4 99 B15R2.19402 COC(=O)C1(N)CCC2=C1C=CC=C2 SC-86876 [0,1,0,1,0,0|2,0,0]=4 100 B15R3.2009 [C@H]12CC3=C(C=CC=C3)[C@H]1NC(=O)O2 SC-44864 [0,0,0,2,0,0|1,0,0]=3 101 B11R1.91 CC(=O)C#CC1=CC=CC=C1 SC-83281 [1,0,0,0,1,0|0,0,2]=4 102 B11R1.91 CC(=O)\C=C\C1=CC=CC=C1 SC-80359 [1,0,0,0,1,0|0,0,2]=4 103 B11R1.91 C[C@H](O)CCC1=CC=CC=C1 SC-A2296 [1,0,0,0,1,0|0,0,2]=4 104 B11R1.91 NC(=O)OCC1=CC=CC=C1 SC-47828 [1,0,0,0,1,0|1,0,0]=3 105 B11R1.91 O=C(Cl)CCC1=CC=CC=C1 SC-06047 [1,0,0,0,1,0|1,0,0]=3 106 B11R1.91 O=C(O)CCC1=NC=CC=C1 SC-50767 [1,0,0,0,1,0|2,0,0]=4 107 B11R1.91 O=C(O)CNC1=CC=CC=C1 SC-75650 [1,0,0,0,1,0|2,0,0]=4 108 B11R1.40 C=CC(=O)OC1=CC=CC=C1 SC-20325 [0,0,0,0,2,0|0,0,2]=4 109 B11R1.40 COC(=O)CC1=CC=CN=C1 SC-47386 [0,0,0,0,2,0|2,0,0]=4 110 B11R1.40 COC(=O)CC1=NC=CC=C1 SC-94137 [0,0,0,0,2,0|2,0,0]=4 111 B11R1.40 O=C(CBr)OC1=CC=CC=C1 SC-90327 [0,0,0,0,2,0|1,0,0]=3 112 B11R1.40 O=C(CCl)CC1=CC=CC=C1 SC-49857 [0,0,0,0,2,0|1,0,0]=3