0 B5R0.1 CCC[C@H](C)N SPC-k309 [0,0,0,0,0,0|1,0,3]=4 1 B4R0.1 CC(=O)CN SPC-t886 [1,0,0,0,0,0|1,0,1]=3 2 B4R0.1 NC(=O)CI SPC-s873 [1,0,0,0,0,0|2,0,1]=4 3 B6R0.1 CCOC(=O)C#N SPC-g163 [0,1,0,0,0,0|1,0,2]=4 4 B6R0.3 CC[C@@H](Br)C(=O)O SPC-t752 [0,1,0,0,0,0|1,0,2]=4 5 B6R0.3 CC[C@H](Br)C(=O)O SPC-t846 [0,1,0,0,0,0|1,0,2]=4 6 B6R0.3 CN[C@@H](C)C(=O)O SPC-s663 [0,1,0,0,0,0|2,0,1]=4 7 B6R0.3 CON(C)C(C)=O SPC-t100 [0,1,0,0,0,0|2,0,0]=3 8 B6R0.3 CO[C@@H](C)C(=O)O SPC-h233 [0,1,0,0,0,0|2,0,1]=4 9 B6R0.3 CO[C@@H](C)C(=O)O SPC-t778 [0,1,0,0,0,0|2,0,1]=4 10 B6R0.4 CC\C=C\C(=O)O SPC-t510 [0,1,0,0,0,0|1,0,0]=2 11 B6R1.2 BrC1=CC=NN1 SPC-n183 [0,0,0,1,0,0|3,0,0]=4 12 B6R1.2 CC1=CNC=C1 SPC-m068 [0,0,0,1,0,0|2,0,0]=3 13 B6R1.2 CC1=CNN=C1 SPC-n152 [0,0,0,1,0,0|3,0,0]=4 14 B6R1.2 CC1=COC=N1 SPC-n151 [0,0,0,1,0,0|2,0,1]=4 15 B6R1.2 CC1=CSC=N1 SPC-g112 [0,0,0,1,0,0|2,0,1]=4 16 B6R1.2 ClC1=CSC=C1 SPC-t726 [0,0,0,1,0,0|2,0,1]=4 17 B6R1.2 ClC1=NNC=C1 SPC-j937 [0,0,0,1,0,0|3,0,0]=4 18 B6R1.2 FC1=NNC=C1 SPC-j936 [0,0,0,1,0,0|3,0,0]=4 19 B6R1.2 IC1=CC=NN1 SPC-p388 [0,0,0,1,0,0|3,0,0]=4 20 B6R1.2 IC1=COCC1 SPC-t718 [0,0,0,1,0,0|2,0,0]=3 21 B6R1.2 NC1=CC=NN1 SPC-g055 [0,0,0,1,0,0|3,0,0]=4 22 B6R1.2 NC1=NOC=C1 SPC-j749 [0,0,0,1,0,0|3,0,0]=4 23 B6R1.2 O=C1C=CCC1 SPC-g207 [0,0,0,1,0,0|0,0,0]=1 24 B6R1.2 O=C1C=CCO1 SPC-t619 [0,0,0,1,0,0|1,0,0]=2 25 B6R1.2 O=C1C=CNN1 SPC-p382 [0,0,0,1,0,0|2,0,0]=3 26 B6R1.2 O=C1CCNC1 SPC-g182 [0,0,0,1,0,0|1,0,1]=3 27 B6R1.2 O=C1CCOC1 SPC-g234 [0,0,0,1,0,0|1,0,1]=3 28 B6R1.5 CC1CC(=O)C1 SPC-n075 [0,0,0,1,0,0|0,0,2]=3 29 B6R1.5 CN1CC(=O)C1 SPC-i955 [0,0,0,1,0,0|1,0,1]=3 30 B6R1.5 CN1CC(=O)C1 SPC-p044 [0,0,0,1,0,0|1,0,1]=3 31 B6R1.5 NC1CC(=O)C1 SPC-g768 [0,0,0,1,0,0|1,0,2]=4 32 B6R1.5 O=C1CC(Br)C1 SPC-i596 [0,0,0,1,0,0|1,0,2]=4 33 B6R1.11 NC(=O)C1CC1 SPC-t155 [0,0,0,1,0,0|1,0,2]=4 34 B5R0.4 C=C[Si](C)(C)C SPC-t167 [1,1,0,0,0,0|1,1,0]=4 35 B7R0.7 [C-]#[N+]CC(=O)OCC SPC-q003 [0,2,0,0,0,0|1,0,1]=4 36 B5R1.2 O=C1CCN1 SPC-t120 [1,0,0,1,0,0|1,0,0]=3 37 B5R1.2 O=C1CNC1 SPC-h722 [1,0,0,1,0,0|1,0,1]=4 38 B5R1.2 O=C1CSC1 SPC-a100 [1,0,0,1,0,0|1,0,1]=4 39 B7R1.1 BrCC1=CCCC1 SPC-n905 [0,1,0,1,0,0|1,0,1]=4 40 B7R1.1 NCC1=NOC=C1 SPC-k851 [0,1,0,1,0,0|2,0,0]=4 41 B7R1.1 O=CC1=CC=NN1 SPC-p008 [0,1,0,1,0,0|2,0,0]=4 42 B7R1.1 O=CC1=CSC=C1 SPC-g519 [0,1,0,1,0,0|1,0,1]=4 43 B7R1.1 OCC1=NNC=C1 SPC-j656 [0,1,0,1,0,0|2,0,0]=4 44 B7R1.1 OCC1=NOC=C1 SPC-k850 [0,1,0,1,0,0|2,0,0]=4 45 B7R1.2 CC1=CC(Cl)=NN1 SPC-j294 [0,1,0,1,0,0|2,0,0]=4 46 B7R1.2 CC1=CC(N)=NN1 SPC-g654 [0,1,0,1,0,0|2,0,0]=4 47 B7R1.2 CC1=CN(C)N=C1 SPC-s115 [0,1,0,1,0,0|2,0,0]=4 48 B7R1.2 CC1=NC(Br)=CS1 SPC-r369 [0,1,0,1,0,0|2,0,0]=4 49 B7R1.2 CC1=NN(C)C=C1 SPC-g247 [0,1,0,1,0,0|1,0,0]=3 50 B7R1.2 CC1=NNC(C)=N1 SPC-j293 [0,1,0,1,0,0|2,0,0]=4 51 B7R1.2 CN1C=CC(Br)=N1 SPC-g829 [0,1,0,1,0,0|2,0,0]=4 52 B7R1.2 CN1C=CC(Cl)=N1 SPC-v037 [0,1,0,1,0,0|2,0,0]=4 53 B7R1.2 CN1C=CC(I)=N1 SPC-u127 [0,1,0,1,0,0|2,0,0]=4 54 B7R1.2 CN1C=C[N+](C)=C1 SPC-m458 [0,1,0,1,0,0|2,0,0]=4 55 B7R1.2 C[C@@H]1CNC(=O)C1 SPC-r288 [0,1,0,1,0,0|0,0,2]=4 56 B7R1.2 C[C@H]1CNC(=O)C1 SPC-n787 [0,1,0,1,0,0|0,0,2]=4 57 B7R1.2 N[C@@H]1CNC(=O)C1 SPC-m128 [0,1,0,1,0,0|1,0,1]=4 58 B7R1.2 N[C@@H]1CNC(=O)C1 SPC-m129 [0,1,0,1,0,0|1,0,1]=4 59 B7R1.2 N[C@@H]1CNC(=O)C1 SPC-m820 [0,1,0,1,0,0|1,0,1]=4 60 B7R1.2 N[C@@H]1CNC(=O)C1 SPC-t534 [0,1,0,1,0,0|1,0,1]=4 61 B7R1.2 O=C1CCC(=O)C1 SPC-h715 [0,1,0,1,0,0|0,0,1]=3 62 B7R1.2 O=C1CC[C@H](O)C1 SPC-q537 [0,1,0,1,0,0|0,0,2]=4 63 B7R1.2 O=C1CNC(=O)C1 SPC-n497 [0,1,0,1,0,0|1,0,1]=4 64 B7R1.2 O=C1C[C@@H](O)CN1 SPC-s696 [0,1,0,1,0,0|1,0,1]=4 65 B7R1.2 O=C1C[C@@H](S)CN1 SPC-u488 [0,1,0,1,0,0|1,0,1]=4 66 B7R1.3 CC1=CC=CN=N1 SPC-g427 [0,1,0,1,0,0|1,0,1]=4 67 B7R1.3 CC1=CCCNC1 SPC-m637 [0,1,0,1,0,0|1,0,1]=4 68 B7R1.3 CC1=CCNCC1 SPC-h455 [0,1,0,1,0,0|1,0,1]=4 69 B7R1.3 CC1=CN=NC=C1 SPC-g520 [0,1,0,1,0,0|2,0,0]=4 70 B7R1.3 CC1=NC=CC=N1 SPC-u374 [0,1,0,1,0,0|1,0,1]=4 71 B7R1.3 CC1=NC=NC=C1 SPC-g053 [0,1,0,1,0,0|1,0,1]=4 72 B7R1.3 O=C1C=CC=NN1 SPC-g446 [0,1,0,1,0,0|1,0,1]=4 73 B7R1.3 O=C1C=CCOC1 SPC-s270 [0,1,0,1,0,0|0,0,0]=2 74 B7R1.3 O=C1C=CN=CN1 SPC-n087 [0,1,0,1,0,0|1,0,1]=4 75 B7R1.3 O=C1CCCNC1 SPC-q237 [0,1,0,1,0,0|0,0,2]=4 76 B7R1.3 O=C1CCCOC1 SPC-g865 [0,1,0,1,0,0|0,0,2]=4 77 B7R1.3 O=C1CCCSC1 SPC-k221 [0,1,0,1,0,0|0,0,2]=4 78 B7R1.3 O=C1CCOCC1 SPC-g072 [0,1,0,1,0,0|0,0,2]=4 79 B7R1.3 O=C1CCSCC1 SPC-g130 [0,1,0,1,0,0|0,0,2]=4 80 B7R1.3 O=C1CNCCN1 SPC-g151 [0,1,0,1,0,0|1,0,1]=4 81 B7R1.3 O=C1COCCN1 SPC-g147 [0,1,0,1,0,0|1,0,1]=4 82 B7R1.4 CC1=C(C)NN=C1 SPC-s309 [0,1,0,1,0,0|2,0,0]=4 83 B7R1.4 CC1=CSC=C1N SPC-p592 [0,1,0,1,0,0|2,0,0]=4 84 B7R1.4 CN1N=CC=C1N SPC-s781 [0,1,0,1,0,0|2,0,0]=4 85 B7R1.4 N[C@H]1CCNC1=O SPC-u507 [0,1,0,1,0,0|1,0,1]=4 86 B7R1.4 N[C@H]1CCOC1=O SPC-s908 [0,1,0,1,0,0|1,0,1]=4 87 B7R1.6 O=CC=C1COC1 SPC-a010 [0,1,0,1,0,0|1,0,1]=4 88 B7R1.10 COC1CC(=O)C1 SPC-i084 [0,1,0,1,0,0|0,0,2]=4 89 B7R1.10 O=C1CC(CBr)C1 SPC-h451 [0,1,0,1,0,0|0,0,2]=4 90 B7R1.10 O=C1CC(CCl)C1 SPC-i140 [0,1,0,1,0,0|0,0,2]=4 91 B7R1.10 O=C1CC(CO)C1 SPC-h515 [0,1,0,1,0,0|0,0,2]=4 92 B7R1.10 O=C1C[C@H](CO)N1 SPC-t669 [0,1,0,1,0,0|1,0,1]=4 93 B7R1.16 CC1(C)CC(=O)C1 SPC-q743 [0,1,0,1,0,0|0,0,2]=4 94 B7R1.16 CC1(N)CC(=O)C1 SPC-s904 [0,1,0,1,0,0|0,0,2]=4 95 B7R1.18 CC(=O)C1CCC1 SPC-h776 [0,1,0,1,0,0|0,0,2]=4 96 B7R1.18 CC(=O)C1COC1 SPC-r005 [0,1,0,1,0,0|0,0,2]=4