0 B14R1.623 CCOC(=O)C1=CC=CC=C1N(C)C CS-0199746 [0,0,0,0,0,0|3,0,0]=3 1 B13R1.464 C#CC1=CC=CC=C1C(=O)OCC CS-0361449 [1,0,0,0,0,0|1,0,1]=3 2 B13R1.464 CCOC(=O)C1=CC=CC=C1C=O CS-W006512 [1,0,0,0,0,0|0,0,0]=1 3 B13R1.464 CCOC(=O)C1=CC=CC=C1CCl CS-0700509 [1,0,0,0,0,0|1,0,1]=3 4 B13R1.464 CCOC(=O)C1=CC=CC=C1NC CS-0019162 [1,0,0,0,0,0|2,0,0]=3 5 B13R1.464 CCOC(=O)C1=CC=CN=C1CO CS-0526907 [1,0,0,0,0,0|1,0,1]=3 6 B13R1.547 CCS(=O)C1=CC=CC=C1C(=O)O CS-0232677 [1,0,0,0,0,0|1,0,0]=2 7 B13R1.547 COC(=O)C1=C([N+](=O)[O-])C=CC=N1 CS-0316717 [1,0,0,0,0,0|2,0,1]=4 8 B13R1.547 COC(=O)C1=C([N+](=O)[O-])N=CC=C1 CS-0699156 [1,0,0,0,0,0|2,0,1]=4 9 B13R1.547 COC(=O)C1=CC=CC=C1C(C)C CS-0154275 [1,0,0,0,0,0|2,0,1]=4 10 B13R1.547 COC(=O)C1=CC=CC=C1C(F)F CS-0210666 [1,0,0,0,0,0|2,0,1]=4 11 B13R1.547 COC(=O)C1=CC=CC=C1C(N)=O CS-0150660 [1,0,0,0,0,0|1,0,0]=2 12 B13R1.547 COC(=O)C1=CC=CC=C1N(C)C CS-0313334 [1,0,0,0,0,0|3,0,0]=4 13 B13R1.547 COC(=O)C1=NC=CC=C1C(C)=O CS-1027012 [1,0,0,0,0,0|2,0,0]=3 14 B13R1.547 O=C(O)C1=CC=CC=C1C(=O)CBr CS-0852896 [1,0,0,0,0,0|1,0,0]=2 15 B13R1.572 CCCNC1=CC=CC=C1C(=O)O CS-0297925 [1,0,0,0,0,0|2,0,0]=3 16 B13R1.572 CCCOC1=C(C(=O)O)N=CC=C1 CS-0309046 [1,0,0,0,0,0|3,0,0]=4 17 B13R1.572 CCCSC1=C(C(=O)O)C=CC=C1 CS-0204535 [1,0,0,0,0,0|2,0,0]=3 18 B13R1.572 CCCSC1=C(C(=O)O)C=CC=N1 CS-0320818 [1,0,0,0,0,0|3,0,0]=4 19 B13R1.572 CCOCC1=CC=CC=C1B(O)O CS-0174093 [1,0,0,0,0,0|1,0,2]=4 20 B13R1.572 NCCSC1=CC=CC=C1C(=O)O CS-0241751 [1,0,0,0,0,0|3,0,0]=4 21 B13R1.572 O=C(O)C1=CC=CC=C1OCCO CS-0250823 [1,0,0,0,0,0|3,0,0]=4 22 B13R1.572 O=C(O)C1=CC=CC=C1SCCO CS-0261515 [1,0,0,0,0,0|3,0,0]=4 23 B15R1.765 CCOC(=O)C1=C([N+](=O)[O-])C=CC(C)=C1 CS-0361596 [0,1,0,0,0,0|1,0,1]=3 24 B15R1.765 CCOC(=O)C1=C([N+](=O)[O-])C=CC(F)=C1 CS-0663831 [0,1,0,0,0,0|1,0,1]=3 25 B15R1.811 CCOC(=O)C1=CC=CC=C1S(N)(=O)=O CS-0151740 [0,1,0,0,0,0|1,0,1]=3 26 B15R1.811 CCOC(=O)C1=CC=NC=C1S(=O)(=O)Cl CS-0089693 [0,1,0,0,0,0|2,0,1]=4 27 B15R1.1239 O=C(O)C1=CC=CC=C1C(=O)OCCO CS-0060467 [0,1,0,0,0,0|0,0,0]=1 28 B15R1.3598 CCCS(=O)(=O)C1=CC=CC=C1C(=O)O CS-0216300 [0,1,0,0,0,0|2,0,0]=3 29 B15R1.5509 CC(C)OC(=O)C1=C(B(O)O)C=CC=C1 CS-0963583 [0,1,0,0,0,0|1,0,1]=3 30 B15R1.10569 CCOC(=O)C1=C([N+](=O)[O-])C=C(N)C=C1 CS-0151833 [0,1,0,0,0,0|1,0,1]=3 31 B15R1.10602 CCOC(=O)C1=C([N+](=O)[O-])C(Cl)=CC=C1 CS-0234161 [0,1,0,0,0,0|1,0,1]=3 32 B15R1.10616 CCOC(=O)C1=C([N+](=O)[O-])C=CC=C1F CS-0130311 [0,1,0,0,0,0|1,0,1]=3 33 B15R2.1221 O=C(O)C1=CC=CC=C1C2=CC=CO2 CS-0313018 [0,0,0,1,0,0|1,0,2]=4 34 B15R2.1221 O=C(O)C1=CC=CC=C1C2=CN=CO2 CS-0208300 [0,0,0,1,0,0|2,0,1]=4 35 B15R2.1221 O=C(O)C1=CC=CC=C1N2CCCC2 CS-0868378 [0,0,0,1,0,0|3,0,0]=4 36 B15R2.4382 CCOC1=NN=C(Cl)C2=C1C=CC=C2 CS-0264971 [0,0,0,1,0,0|3,0,0]=4 37 B13R1.467 CCOC(=O)C1=C(B(O)O)C=CO1 CS-0042633 [0,0,0,0,1,0|2,0,1]=4 38 B15R1.1274 CCCC(=O)NC1=CC=CC=C1C(=O)O CS-0326771 [0,0,0,0,0,1|1,0,0]=2 39 B15R1.1274 CCCC(=O)OC1=CC=CC=C1[N+](=O)[O-] CS-0152459 [0,0,0,0,0,1|2,0,1]=4 40 B15R1.1274 CCOC(=O)CC1=C(C(=O)O)C=CC=N1 CS-0215546 [0,0,0,0,0,1|1,0,0]=2 41 B15R1.1274 COCC(=O)NC1=C(C(=O)O)C=CC=C1 CS-0713931 [0,0,0,0,0,1|2,0,0]=3 42 B15R1.1274 N#CCC(=O)NC1=CC=CC=C1C(=O)O CS-0219898 [0,0,0,0,0,1|2,0,1]=4 43 B15R1.1274 NC(=O)C1=CC=CC=C1NC(=O)CCCl CS-0216178 [0,0,0,0,0,1|3,0,0]=4 44 B12R1.77 C=CC1=CC=CC=C1C(=O)OC CS-0162905 [2,0,0,0,0,0|1,0,0]=3 45 B12R1.77 COC(=O)C1=C(C=O)N=CC=C1 CS-0215082 [2,0,0,0,0,0|1,0,0]=3 46 B12R1.308 CCCC(=O)C1=CC=CC=C1O CS-0152466 [2,0,0,0,0,0|1,0,0]=3 47 B12R1.308 CCNC(=O)C1=C(Br)C=CC=C1 CS-0037638 [2,0,0,0,0,0|2,0,0]=4 48 B12R1.308 CCNC(=O)C1=C(O)C=CC=C1 CS-0037834 [2,0,0,0,0,0|1,0,0]=3 49 B12R1.308 CCNC(=O)C1=CC=CC=C1I CS-0665017 [2,0,0,0,0,0|2,0,0]=4 50 B12R1.308 CCNC(=O)C1=CC=CC=C1N CS-0212959 [2,0,0,0,0,0|2,0,0]=4 51 B12R1.308 CCOC(=O)C1=C(O)C=CC=N1 CS-0043811 [2,0,0,0,0,0|1,0,0]=3 52 B12R1.308 CCOC(=O)C1=CC=CN=C1F CS-0089688 [2,0,0,0,0,0|2,0,0]=4 53 B12R1.308 CCOC(=O)C1=CC=NC=C1N CS-0005452 [2,0,0,0,0,0|2,0,0]=4 54 B12R1.308 CCOC(=O)C1=CN=CC=C1Cl CS-0199780 [2,0,0,0,0,0|2,0,0]=4 55 B12R1.308 CCOC(=O)C1=CN=CC=C1O CS-0089684 [2,0,0,0,0,0|1,0,0]=3 56 B12R1.308 CCOC(=O)C1=CN=CN=C1O CS-0090766 [2,0,0,0,0,0|2,0,0]=4 57 B12R1.308 O=C(CCCl)C1=CC=CC=C1O CS-0516331 [2,0,0,0,0,0|2,0,0]=4 58 B12R1.261 CC(=O)C1=CC=CC=C1C(C)=O CS-0261352 [2,0,0,0,0,0|1,0,0]=3 59 B12R1.261 CN(C)C1=CC=CC=C1C(=O)O CS-0658679 [2,0,0,0,0,0|2,0,0]=4 60 B12R1.261 CS(=O)C1=CC=CC=C1C(=O)O CS-0449421 [2,0,0,0,0,0|1,0,0]=3 61 B12R1.261 NC(=O)C1=C(C(=O)O)C=CC=N1 CS-0038686 [2,0,0,0,0,0|2,0,0]=4 62 B12R1.283 CCNC1=C(C(=O)O)C=CC=C1 CS-0070497 [2,0,0,0,0,0|1,0,0]=3 63 B12R1.283 CCOC1=C(C(=O)O)N=CC=N1 CS-0444693 [2,0,0,0,0,0|2,0,0]=4 64 B12R1.283 CCOC1=C(C(C)=O)C=CC=N1 CS-0454447 [2,0,0,0,0,0|2,0,0]=4 65 B12R1.283 CCOC1=CC=CC=C1C(C)O CS-0252503 [2,0,0,0,0,0|1,0,1]=4 66 B12R1.283 CCOC1=CC=CC=C1C(N)=S CS-0250728 [2,0,0,0,0,0|1,1,0]=4 67 B12R1.283 CCOC1=CN=CC=C1C(=O)O CS-0043812 [2,0,0,0,0,0|1,0,0]=3 68 B12R1.283 CCSC1=C(C(=O)O)C=CC=C1 CS-0073246 [2,0,0,0,0,0|0,1,0]=3 69 B12R1.283 COCC1=CC=CC=C1C(=O)O CS-0150188 [2,0,0,0,0,0|0,0,1]=3 70 B14R1.599 CCOC(=O)C1=C(CBr)C=CC(Br)=C1 CS-0679662 [1,1,0,0,0,0|1,0,1]=4 71 B14R1.599 CCOC(=O)C1=C(OC)C=CC(N)=C1 CS-0768089 [1,1,0,0,0,0|2,0,0]=4 72 B14R1.599 CCOC(=O)C1=CC(F)=CC=C1C#N CS-0694570 [1,1,0,0,0,0|1,0,1]=4 73 B14R1.840 CNC1=CC=CC=C1C(=O)OC(C)C CS-0257678 [1,1,0,0,0,0|2,0,0]=4 74 B14R1.7233 CCOC(=O)C1=C(OC)C=C(N)C=C1 CS-0061552 [1,1,0,0,0,0|2,0,0]=4 75 B14R1.429 CC(C)N(C)C1=CC=CC=C1C(=O)O CS-0260405 [1,1,0,0,0,0|2,0,0]=4 76 B14R1.429 CN(C)C(=O)C1=CC=CC=C1C(=O)O CS-0208475 [1,1,0,0,0,0|1,0,0]=3 77 B14R1.707 COC(=O)C1=C(B(O)O)C=CC(C)=C1 CS-0119595 [1,1,0,0,0,0|1,0,1]=4 78 B14R1.707 COC(=O)C1=C([N+](=O)[O-])C=CC(O)=C1 CS-0210731 [1,1,0,0,0,0|1,0,1]=4 79 B14R1.707 COC(=O)C1=CC(Cl)=CC=C1C(=O)O CS-0541749 [1,1,0,0,0,0|0,0,0]=2 80 B14R1.746 CNC(=O)C1=C(C(=O)NC)C=CC=C1 CS-0018019 [1,1,0,0,0,0|2,0,0]=4 81 B14R1.746 COC(=O)C1=C(C(=O)OC)C=CC=C1 CS-0138256 [1,1,0,0,0,0|0,0,0]=2 82 B14R1.746 COC(=O)C1=NC=CN=C1C(=O)OC CS-0465992 [1,1,0,0,0,0|2,0,0]=4 83 B14R1.1164 COC(=O)C1=C(N(=O)=O)C=CC=C1N CS-0205361 [1,1,0,0,0,0|1,0,1]=4 84 B14R1.67 CCCOC1=C(C(=O)O)C=C(Cl)C=C1 CS-0191508 [1,1,0,0,0,0|2,0,0]=4 85 B14R1.760 CCCOC1=C(C(=O)O)C=CC(Br)=C1 CS-0208533 [1,1,0,0,0,0|2,0,0]=4 86 B14R1.903 CCCCOC1=CC=CC=C1C(=O)O CS-0314193 [1,1,0,0,0,0|1,0,1]=4 87 B14R1.903 COCCOC1=C(C(=O)O)C=CC=C1 CS-0205021 [1,1,0,0,0,0|2,0,0]=4 88 B14R1.3302 CCC(=O)OC1=CC=CC=C1C(=O)O CS-0524625 [1,1,0,0,0,0|2,0,0]=4 89 B14R1.4522 CC(C)CSC1=C(C(=O)O)C=CC=C1 CS-0204741 [1,1,0,0,0,0|2,0,0]=4 90 B14R1.7271 CCOC(=O)C1=C(C(=O)O)NC=C1C CS-0698513 [0,1,0,0,1,0|1,0,0]=3 91 B16R1.960 CCOC(=O)C1=CC=CC=C1NC(=O)CCl CS-0218702 [0,1,0,0,0,1|1,0,0]=3 92 B16R1.1519 CCCC(=O)NC1=C(C(=O)O)C=CC(Cl)=C1 CS-0359127 [0,1,0,0,0,1|1,0,0]=3 93 B16R1.2220 CCNC(=O)NC1=CC=CC(F)=C1C(=O)O CS-0252556 [0,1,0,0,0,1|1,0,0]=3 94 B16R1.12463 CC(=O)CC(=O)NC1=CC=CC=C1C(=O)O CS-0186402 [0,1,0,0,0,1|1,0,1]=4 95 B16R1.12463 CC(C)CC(=O)NC1=CC=CC=C1C(=O)O CS-0244682 [0,1,0,0,0,1|1,0,0]=3 96 B16R1.13671 CCCC(=O)NC1=C(C(=O)O)C=C(Br)C=C1 CS-0211577 [0,1,0,0,0,1|1,0,0]=3 97 B16R1.886 CCOC(=O)C1=CC(Br)=CC=C1S(=O)(=O)Cl CS-0230642 [0,2,0,0,0,0|1,0,1]=4 98 B16R1.70638 CCOC(=O)C1=CC(Cl)=C(Br)C=C1[N+](=O)[O-] CS-0868286 [0,2,0,0,0,0|1,0,1]=4 99 B16R1.14964 CCOC(=O)C1=CC=NN=C1C(=O)OCC CS-W022624 [0,2,0,0,0,0|2,0,0]=4 100 B16R1.1730 CCCCOC(=O)C1=CC=CC=C1C(=O)[O-] CS-0450367 [0,2,0,0,0,0|0,0,1]=3 101 B16R1.4547 CC(=O)COC(=O)C1=CC=CC=C1[N+](=O)[O-] CS-0667201 [0,2,0,0,0,0|1,0,1]=4 102 B16R1.4547 CC(C)COC(=O)C1=CC=CC=C1B(O)O CS-0173954 [0,2,0,0,0,0|1,0,1]=4 103 B16R1.12449 CC(C)NS(=O)(=O)C1=CC=CC=C1C(=O)O CS-0222114 [0,2,0,0,0,0|2,0,0]=4 104 B16R1.12475 CC(C)(C)NC(=O)C1=CC=CC=C1C(=O)O CS-0221694 [0,2,0,0,0,0|1,0,0]=3 105 B16R1.12475 CC(C)(C)OC(=O)C1=CC=CC=C1C(=O)O CS-0272768 [0,2,0,0,0,0|0,0,0]=2 106 B16R1.69082 CCOC(=O)C1=C([N+](=O)[O-])C=C(OC)C=C1 CS-0211164 [0,2,0,0,0,0|1,0,1]=4 107 B14R1.32 CCOC(=O)\C=C\C1=CC(O)=CC=C1 CS-0047066 [0,0,1,1,0,0|1,0,0]=3 108 B14R2.215 CNN1C(=O)C2=CC=CC=C2C1=O CS-0150989 [1,0,0,1,0,0|2,0,0]=4 109 B14R2.7150 CCOC1=CC=CC2=C1C=CC=C2 CS-0197266 [1,0,0,1,0,0|2,0,0]=4 110 B14R2.7724 CN1NC(=O)C2=CC=CC=C2C1=O CS-0090894 [1,0,0,1,0,0|2,0,0]=4 111 B14R2.17370 COC1(C)OC(=O)C2=CC=CC=C21 CS-0037781 [1,0,0,1,0,0|1,0,1]=4 112 B14R2.29285 O=C1CCS(=O)(=O)C2=CC=CC=C12 CS-0307706 [1,0,0,1,0,0|1,0,1]=4 113 B14R2.31359 O=C(O)C1=CC=CC2=C1CNCC2 CS-0186284 [1,0,0,1,0,0|1,0,1]=4 114 B14R2.31359 O=C(O)C1=CC=CC2=C1NCCC2 CS-0141114 [1,0,0,1,0,0|2,0,0]=4 115 B16R2.3033 O=C(O)C1=CC=CC=C1N2CCCC2=O CS-0664990 [0,0,0,1,0,1|1,0,0]=3 116 B16R2.3033 O=C1OCCN1C2=CC=CC=C2[N+](=O)[O-] CS-0269700 [0,0,0,1,0,1|1,0,1]=4 117 B16R2.27521 O=C(O)C1=C(NC(=O)C2CC2)C=CC=C1 CS-0215114 [0,0,0,1,0,1|1,0,0]=3 118 B16R2.1160 COC(=O)C1=CC=CC=C1C2OCCO2 CS-0565629 [0,1,0,1,0,0|0,0,2]=4 119 B12R1.316 CCOC(=O)C1=C(C=O)C=CN1 CS-W022672 [1,0,0,0,1,0|1,0,0]=3 120 B12R1.316 CCOC(=O)C1=C(C=O)SC=C1 CS-0061558 [1,0,0,0,1,0|1,0,0]=3 121 B14R1.965 CCOC(=O)CC1=CC=CC=C1OC CS-0317484 [1,0,0,0,0,1|2,0,0]=4 122 B14R1.965 CCOC(=O)NC1=CC=CC=C1C#N CS-0216607 [1,0,0,0,0,1|1,0,1]=4 123 B14R1.617 CCOC(=O)C1=CN=CC(C(=O)O)=C1 CS-0172324 [0,0,0,0,1,1|1,0,0]=3 124 B16R1.959 CCOC(=O)C1=CC=CN=C1SCC(=O)O CS-0249583 [0,0,0,0,0,2|1,0,0]=3 125 B16R1.4440 CCOC(=O)CCC1=CC=CC=C1[N+](=O)[O-] CS-0454710 [0,0,0,0,0,2|1,0,1]=4 126 B16R1.4440 CCOC(=O)CNC1=CC=CC=C1[N+](=O)[O-] CS-0209782 [0,0,0,0,0,2|1,0,1]=4 127 B16R1.4440 CCOC(=O)COC1=CC=CC=C1C(C)=O CS-0247744 [0,0,0,0,0,2|1,0,0]=3 128 B16R1.4440 CCOC(=O)COC1=CC=CC=C1[N+](=O)[O-] CS-0206674 [0,0,0,0,0,2|1,0,1]=4 129 B16R1.4440 CCOC(=O)\C=C\C1=C(B(O)O)C=CC=C1 CS-0962359 [0,0,0,0,0,2|1,0,1]=4