0 B11R1.509 CS(=O)(=O)CC1=CC=CC=C1 B7832 [0,0,0,0,0,0|2,0,1]=3 1 B11R1.509 CS(=O)(=O)NC1=CC=CC=C1 P7869 [0,0,0,0,0,0|3,0,1]=4 2 B11R1.509 FC(F)(F)OC1=CC=CC=C1 T7520 [0,0,0,0,0,0|4,0,0]=4 3 B10R1.18 CN(C)CC1=CC=CC=C1 D18840 [1,0,0,0,0,0|1,0,0]=2 4 B10R1.18 N=C(N)CC1=CC=CC=C1 P13924 [1,0,0,0,0,0|2,0,1]=4 5 B10R1.18 O=C(O)CC1=CC=CN=C1 P3052 [1,0,0,0,0,0|2,0,1]=4 6 B10R1.18 O=C(O)CC1=CC=NC=C1 P7971 [1,0,0,0,0,0|2,0,1]=4 7 B10R1.18 O=C(O)CC1=NC=CC=C1 P7970 [1,0,0,0,0,0|2,0,1]=4 8 B12R1.106 CC(C)(C)OC1=CC=C(Cl)C=C1 T8393 [0,1,0,0,0,0|2,0,0]=3 9 B12R1.106 CS(=O)(=O)CC1=CC=C(F)C=C1 F8528 [0,1,0,0,0,0|2,0,1]=4 10 B12R1.119 CS(=O)(=O)CC1=CC=CC(F)=C1 F8526 [0,1,0,0,0,0|2,0,1]=4 11 B12R1.151 CS(=O)(=O)CC1=C(F)C=CC=C1 F8527 [0,1,0,0,0,0|2,0,1]=4 12 B12R1.151 C[Si](C)(C)CC1=CC=CC=C1Cl C16512 [0,1,0,0,0,0|1,1,0]=3 13 B12R1.564 CC(C)(Br)C(=O)C1=CC=CC=C1 B10178 [0,1,0,0,0,0|1,0,1]=3 14 B12R1.564 CC(C)(C)C(N)C1=CC=CC=C1 D7600 [0,1,0,0,0,0|1,0,0]=2 15 B12R2.95 FC1(F)OC2=C(C=CC=C2)O1 D7456 [0,0,0,1,0,0|3,0,0]=4 16 B10R1.28 CC(C)(C)C1=CC=NC=C1 T19209 [0,0,0,0,1,0|2,0,0]=3 17 B10R1.281 C[Si](C)(C)CC1=CC=CS1 T16682 [0,0,0,0,1,0|2,1,0]=4 18 B12R1.891 FC(F)(F)SCC1=CC=CC=C1 B3915 [0,0,0,0,0,1|3,0,0]=4 19 B9R1.8 BrCCC1=CC=CC=C1 B1499 [2,0,0,0,0,0|1,0,0]=3 20 B9R1.8 BrCCC1=NC=CC=C1 B18468 [2,0,0,0,0,0|2,0,0]=4 21 B9R1.8 CCC[N+]1=CC=CC=C1 P9114 [2,0,0,0,0,0|1,0,0]=3 22 B9R1.8 CNCC1=CC=CC=C1 C12471 [2,0,0,0,0,0|1,0,0]=3 23 B9R1.8 CNCC1=CN=CC=C1 M13405 [2,0,0,0,0,0|2,0,0]=4 24 B9R1.8 C\N=C/C1=CC=CC=C1 B11532 [2,0,0,0,0,0|1,0,1]=4 25 B9R1.8 NCCC1=CC=CC=C1 P18797 [2,0,0,0,0,0|1,0,0]=3 26 B9R1.8 NCCC1=CC=CC=C1 P19425 [2,0,0,0,0,0|1,0,0]=3 27 B9R1.8 NCCC1=CC=CC=N1 P3233 [2,0,0,0,0,0|2,0,0]=4 28 B9R1.8 NCCC1=CC=CN=C1 A18111 [2,0,0,0,0,0|2,0,0]=4 29 B9R1.8 NCCC1=CC=NC=C1 A18195 [2,0,0,0,0,0|2,0,0]=4 30 B9R1.8 NCCC1=CN=CC=C1 A12910 [2,0,0,0,0,0|2,0,0]=4 31 B9R1.8 NNCC1=CC=CC=C1 B8798 [2,0,0,0,0,0|2,0,0]=4 32 B9R1.8 NOCC1=CC=CC=C1 B7490 [2,0,0,0,0,0|2,0,0]=4 33 B9R1.8 NOCC1=CC=CC=C1 B7490 [2,0,0,0,0,0|2,0,0]=4 34 B9R1.8 OCCC1=NC=CC=C1 P0121 [2,0,0,0,0,0|1,0,0]=3 35 B9R1.8 OCCC1=NC=CN=C1 H13361 [2,0,0,0,0,0|2,0,0]=4 36 B9R1.8 O\N=C/C1=CC=CC=C1 B18348 [2,0,0,0,0,0|1,0,1]=4 37 B11R1.20 CC(C)CC1=CC=C(Br)C=C1 B9590 [1,1,0,0,0,0|0,0,0]=2 38 B11R1.20 CC1=CC=C(CC(=O)O)C=C1 T2230 [1,1,0,0,0,0|1,0,1]=4 39 B11R1.20 NC1=CC=C(CC(=O)O)C=C1 A0970 [1,1,0,0,0,0|1,0,1]=4 40 B11R1.20 O=C(O)CC1=CC=C(Br)C=C1 B1332 [1,1,0,0,0,0|1,0,1]=4 41 B11R1.20 O=C(O)CC1=CC=C(Br)C=C1 B1332 [1,1,0,0,0,0|1,0,1]=4 42 B11R1.20 O=C(O)CC1=CC=C(Cl)C=C1 C11770 [1,1,0,0,0,0|1,0,1]=4 43 B11R1.20 O=C(O)CC1=CC=C(F)C=C1 F0757 [1,1,0,0,0,0|1,0,1]=4 44 B11R1.20 O=C(O)CC1=CC=C(O)C=C1 H4994 [1,1,0,0,0,0|1,0,1]=4 45 B11R1.36 CC(Br)C(=O)C1=CC=CC=C1 B9586 [1,1,0,0,0,0|1,0,1]=4 46 B11R1.36 CC(Br)C(=O)C1=CC=CC=C1 B9586 [1,1,0,0,0,0|1,0,1]=4 47 B11R1.36 CC(C(=O)O)C1=CC=CC=C1 P18879 [1,1,0,0,0,0|1,0,1]=4 48 B11R1.36 N[C@H](C(=O)O)C1=CC=CC=C1 P6188 [1,1,0,0,0,0|1,0,1]=4 49 B11R1.36 O=C(O)C(Br)C1=CC=CC=C1 P6912 [1,1,0,0,0,0|1,0,1]=4 50 B11R1.36 O=C(O)C(Br)C1=CC=CC=C1 P6912 [1,1,0,0,0,0|1,0,1]=4 51 B11R1.36 O=C(O)[C@@H](O)C1=CC=CC=C1 M5987 [1,1,0,0,0,0|1,0,1]=4 52 B11R1.36 O=C(O)[C@@H](O)C1=CC=CC=C1 M5987 [1,1,0,0,0,0|1,0,1]=4 53 B11R1.36 O=C(O)[C@H](O)C1=CC=CC=C1 M0801 [1,1,0,0,0,0|1,0,1]=4 54 B11R1.40 N[C@@H](CO)CC1=CC=CC=C1 A2030 [1,1,0,0,0,0|1,0,0]=3 55 B11R1.40 N[C@H](CO)CC1=CC=CC=C1 P5891 [1,1,0,0,0,0|1,0,0]=3 56 B11R1.40 N[C@H](CO)CC1=CC=CC=C1 P5891 [1,1,0,0,0,0|1,0,0]=3 57 B11R1.86 CC1=CC=CC=C1CC(=O)O T4259 [1,1,0,0,0,0|1,0,1]=4 58 B11R1.86 O=C(O)CC1=C(Br)C=CC=C1 B3813 [1,1,0,0,0,0|1,0,1]=4 59 B11R1.86 O=C(O)CC1=C(Cl)C=CC=C1 C7842 [1,1,0,0,0,0|1,0,1]=4 60 B11R1.86 O=C(O)CC1=C(O)C=CC=C1 H1271 [1,1,0,0,0,0|1,0,1]=4 61 B11R1.86 O=C(O)CC1=CC=CC=C1F F1336 [1,1,0,0,0,0|1,0,1]=4 62 B11R1.157 NC1=CC(CC(=O)O)=CC=C1 A5096 [1,1,0,0,0,0|1,0,1]=4 63 B11R1.157 O=C(O)CC1=CC(Br)=CC=C1 B3814 [1,1,0,0,0,0|1,0,1]=4 64 B11R1.157 O=C(O)CC1=CC(Cl)=CC=C1 C0700 [1,1,0,0,0,0|1,0,1]=4 65 B11R1.157 O=C(O)CC1=CC=CC(F)=C1 F1337 [1,1,0,0,0,0|1,0,1]=4 66 B11R1.157 O=C(O)CC1=CC=CC(F)=C1 F1337 [1,1,0,0,0,0|1,0,1]=4 67 B11R1.19 CC(C)(C)C1=CC=C(Br)C=C1 B3471 [0,1,0,0,1,0|1,0,0]=3 68 B11R1.19 CC(C)(C)C1=CC=C(N)C=C1 B1468 [0,1,0,0,1,0|1,0,0]=3 69 B11R1.19 CC(C)(C)C1=CC=C(N)C=C1 B1468 [0,1,0,0,1,0|1,0,0]=3 70 B11R1.19 CC(C)(C)C1=CC=C(S)C=C1 T7730 [0,1,0,0,1,0|1,0,0]=3 71 B11R1.87 CC(C)(C)C1=CC=CC=C1N T17716 [0,1,0,0,1,0|1,0,0]=3 72 B11R1.155 CC(C)(C)C1=CC=CC(Br)=C1 B3472 [0,1,0,0,1,0|1,0,0]=3 73 B13R1.353 CC(C)(C)C(=O)CC1=NC=CC=C1 D8101 [0,1,0,0,0,1|2,0,0]=4 74 B13R1.353 CC(C)(C)C(=O)NC1=CC=CC=C1 P15016 [0,1,0,0,0,1|1,0,1]=4 75 B13R1.838 CC(C)(O)C#CC1=CC=CC(N)=C1 M2097 [0,1,0,0,0,1|0,0,1]=3 76 B13R1.4 COC1=CC=C(C[Si](C)(C)C)C=C1 M16620 [0,2,0,0,0,0|1,1,0]=4 77 B13R1.622 C[Si](C)(C)CC1=CC=CC=C1C#N T16681 [0,2,0,0,0,0|1,1,0]=4 78 B13R1.1073 CC(C)(OC1=CC=CC=C1)C(=O)O M13973 [0,2,0,0,0,0|1,0,0]=3 79 B13R1.1073 C[C@@](N)(CC1=CC=CC=C1)C(=O)O M8177 [0,2,0,0,0,0|1,0,0]=3 80 B13R1.1073 C[C@](N)(CC1=CC=CC=C1)C(=O)O M8176 [0,2,0,0,0,0|1,0,0]=3 81 B11R2.10 CC1CC2=CC=CC=C2N1 M1671 [1,0,0,1,0,0|1,0,0]=3 82 B9R1.6 CN(C)C1=CC=NC=C1 D2370 [1,0,0,0,1,0|2,0,0]=4 83 B9R1.6 C[C@@H](N)C1=CC=CC=C1 M5022 [1,0,0,0,1,0|1,0,0]=3 84 B9R1.6 C[C@H](N)C1=CC=CC=C1 M5997 [1,0,0,0,1,0|1,0,0]=3 85 B9R1.6 OB(O)C1=CC=CC=C1 N2145 [1,0,0,0,1,0|2,0,0]=4 86 B9R1.13 CC(C)CC1=NC=CS1 I5359 [1,0,0,0,1,0|2,0,0]=4 87 B11R1.91 CC(N)CCC1=CC=CC=C1 M0184 [1,0,0,0,0,1|1,0,0]=3 88 B11R1.91 O=C(O)CCC1=CC=CC=C1 P11665 [1,0,0,0,0,1|1,0,1]=4 89 B11R1.91 O=C(O)CNC1=CC=CC=C1 P17764 [1,0,0,0,0,1|1,0,1]=4 90 B11R1.91 O=C(O)CSC1=CC=CC=C1 T3907 [1,0,0,0,0,1|1,0,1]=4