0 B11R1.182 CCNC1=C(C)C=CC(O)=C1 BBL100468 [0,0,0,0,0,0|3,0,0]=3 1 B11R1.182 CNCC1=C(O)C=CC(Br)=C1 BBL036631 [0,0,0,0,0,0|4,0,0]=4 2 B10R1.4 C=CCC1=C(O)C=CC=C1 BBL027374 [1,0,0,0,0,0|2,0,1]=4 3 B10R1.10 CNCC1=CC(N)=CC=C1 BBL011550 [1,0,0,0,0,0|3,0,0]=4 4 B10R1.10 NCCC1=CC=CC(F)=C1 BBL012999 [1,0,0,0,0,0|1,0,0]=2 5 B10R1.30 CC1=CC=C(Cl)C=C1NN BBL022189 [1,0,0,0,0,0|2,0,0]=3 6 B10R1.30 CCC1=C(N)C=CC(I)=C1 BBL018999 [1,0,0,0,0,0|2,0,0]=3 7 B10R1.30 NNC1=CC(F)=CC=C1Cl BBL011333 [1,0,0,0,0,0|3,0,0]=4 8 B12R1.127 CC1=C(NC(N)=S)C=C(Cl)C=C1 BBL036238 [0,1,0,0,0,0|2,0,1]=4 9 B12R1.127 CC1=CC=C(C)C(NC(N)=S)=C1 BBL023093 [0,1,0,0,0,0|1,0,1]=3 10 B12R1.127 CC1=CC=C(Cl)C(CC(=O)O)=C1 BBL020349 [0,1,0,0,0,0|2,0,1]=4 11 B12R1.127 CC1=CC=C(N)C(OC(F)F)=C1 BBL039028 [0,1,0,0,0,0|3,0,0]=4 12 B12R1.268 COC1=C(N=C=O)C=C(C)C=C1 BBL104390 [0,1,0,0,0,0|2,0,1]=4 13 B12R1.354 CCC(=O)C1=CC(C)=CC=C1C BBL036405 [0,1,0,0,0,0|1,0,1]=3 14 B12R1.354 CCC(N)C1=C(Cl)C=CC(Cl)=C1 BBL008269 [0,1,0,0,0,0|3,0,0]=4 15 B12R1.374 CC1=CC(OCCN)=C(Cl)C=C1 BBL008288 [0,1,0,0,0,0|1,0,0]=2 16 B12R1.374 CCCOC1=CC(C)=CC=C1N BBL019268 [0,1,0,0,0,0|2,0,0]=3 17 B10R1.130 CC1=CC(C)=NN1CCCl BBL028397 [0,0,0,0,1,0|3,0,0]=4 18 B10R1.130 CC1=CC(C)=NN1CCN BBL030285 [0,0,0,0,1,0|2,0,0]=3 19 B10R1.130 CCCN1N=C(C)C=C1C BBL040882 [0,0,0,0,1,0|3,0,0]=4 20 B10R1.187 CC1=NOC(C)=C1CCBr BBL023682 [0,0,0,0,1,0|3,0,0]=4 21 B9R1.8 BrCCC1=CC=CC=C1 BBL027290 [2,0,0,0,0,0|1,0,0]=3 22 B9R1.8 COCC1=CC=CC=C1 BBL011461 [2,0,0,0,0,0|2,0,0]=4 23 B9R1.8 ClCCC1=CC=CC=C1 BBL027318 [2,0,0,0,0,0|1,0,0]=3 24 B9R1.8 NNCC1=CC=CC=C1 BBL029077 [2,0,0,0,0,0|1,0,0]=3 25 B9R1.8 NOCC1=CC=CC=C1 BBL040921 [2,0,0,0,0,0|1,0,0]=3 26 B9R1.8 OCCC1=CC=CC=C1 BBL036905 [2,0,0,0,0,0|1,0,0]=3 27 B9R1.8 OCCC1=NC=CC=C1 BBL027580 [2,0,0,0,0,0|2,0,0]=4 28 B9R1.15 CC1=C(CBr)N=CC=C1 BBL038258 [2,0,0,0,0,0|2,0,0]=4 29 B9R1.15 CC1=C(NN)C=CC=C1 BBL007626 [2,0,0,0,0,0|1,0,0]=3 30 B9R1.15 ClCC1=C(Cl)C=CC=C1 BBL012560 [2,0,0,0,0,0|2,0,0]=4 31 B9R1.15 NC1=CC=CC=C1CO BBL027657 [2,0,0,0,0,0|2,0,0]=4 32 B9R1.15 NNC1=C(F)C=CC=C1 BBL027973 [2,0,0,0,0,0|2,0,0]=4 33 B9R1.15 NNC1=CC=CC=C1Br BBL012157 [2,0,0,0,0,0|2,0,0]=4 34 B9R1.15 NNC1=CC=CC=C1I BBL022200 [2,0,0,0,0,0|2,0,0]=4 35 B9R1.2 BrCC1=CC(Br)=CC=C1 BBL019514 [2,0,0,0,0,0|2,0,0]=4 36 B9R1.2 CC1=CC=CC(NN)=C1 BBL012136 [2,0,0,0,0,0|1,0,0]=3 37 B9R1.2 ClCC1=CC=CC(Br)=C1 BBL027952 [2,0,0,0,0,0|2,0,0]=4 38 B9R1.2 NC1=CC(CO)=CC=C1 BBL003537 [2,0,0,0,0,0|2,0,0]=4 39 B9R1.2 NCC1=CC(N)=CC=C1 BBL011549 [2,0,0,0,0,0|1,0,0]=3 40 B9R1.2 NNC1=CC(Br)=CC=C1 BBL020531 [2,0,0,0,0,0|2,0,0]=4 41 B9R1.2 NNC1=CC=CC(Cl)=C1 BBL020462 [2,0,0,0,0,0|2,0,0]=4 42 B9R1.2 NNC1=CC=CC(F)=C1 BBL012159 [2,0,0,0,0,0|2,0,0]=4 43 B9R1.69 CC1=C(F)C=C(N)C=C1 BBL100253 [2,0,0,0,0,0|2,0,0]=4 44 B9R1.69 CC1=C(N)C=C(N)C=C1 BBL011285 [2,0,0,0,0,0|1,0,0]=3 45 B9R1.69 CC1=CC(=O)C=CC1=O BBL037012 [2,0,0,0,0,0|2,0,0]=4 46 B9R1.69 CC1=CC(C)=C(O)C=C1 BBL011443 [2,0,0,0,0,0|1,0,0]=3 47 B9R1.69 CC1=CC(N)=C(N)C=C1 BBL013178 [2,0,0,0,0,0|1,0,0]=3 48 B9R1.69 CC1=CC(N)=C(O)C=C1 BBL001485 [2,0,0,0,0,0|1,0,0]=3 49 B9R1.69 CC1=CC(O)=C(N)C=C1 BBL002991 [2,0,0,0,0,0|2,0,0]=4 50 B9R1.69 NC1=CC(Cl)=CC=C1Cl BBL037329 [2,0,0,0,0,0|2,0,0]=4 51 B9R1.69 NC1=CC(Cl)=CC=C1O BBL012067 [2,0,0,0,0,0|2,0,0]=4 52 B9R1.69 NC1=CC=C(Cl)C=C1N BBL027789 [2,0,0,0,0,0|2,0,0]=4 53 B11R1.17 CC1=CC=CC=C1OCCBr BBL028170 [1,1,0,0,0,0|1,0,0]=3 54 B11R1.17 CCCOC1=C(N)C=CC=C1 BBL035841 [1,1,0,0,0,0|2,0,0]=4 55 B11R1.17 CCCSC1=CC=CC=C1N BBL034973 [1,1,0,0,0,0|2,0,0]=4 56 B11R1.17 ClC1=CC=CC=C1OCCBr BBL029543 [1,1,0,0,0,0|2,0,0]=4 57 B11R1.17 NC1=CC=CC=C1OCCO BBL013148 [1,1,0,0,0,0|2,0,0]=4 58 B11R1.17 NCCOC1=CC=CC=C1Cl BBL002953 [1,1,0,0,0,0|1,0,0]=3 59 B11R1.17 NCCOC1=CC=CC=C1F BBL002954 [1,1,0,0,0,0|1,0,0]=3 60 B11R1.41 COC1=CC=CC=C1CCN BBL027693 [1,1,0,0,0,0|0,0,0]=2 61 B11R1.86 CC1=CC=CC=C1NC(N)=S BBL027968 [1,1,0,0,0,0|1,0,1]=4 62 B11R1.86 NC(=O)CC1=CC=CC=C1O BBL003575 [1,1,0,0,0,0|1,0,1]=4 63 B11R1.222 CC1=C(C(=O)NN)C=CC=C1 BBL008111 [1,1,0,0,0,0|1,0,1]=4 64 B11R1.23 CC1=CC=CC(C(=O)NN)=C1 BBL008738 [1,1,0,0,0,0|1,0,1]=4 65 B11R1.23 CCC(N)C1=CC(Cl)=CC=C1 BBL017841 [1,1,0,0,0,0|2,0,0]=4 66 B11R1.23 OC1=CC(C(CN)O)=CC=C1 BBL028398 [1,1,0,0,0,0|1,0,0]=3 67 B11R1.24 CC1=CC(OCCBr)=CC=C1 BBL029542 [1,1,0,0,0,0|1,0,0]=3 68 B11R1.24 CC1=CC=CC(NCCO)=C1 BBL022936 [1,1,0,0,0,0|1,0,0]=3 69 B11R1.24 NC1=CC(OCCO)=CC=C1 BBL029833 [1,1,0,0,0,0|2,0,0]=4 70 B11R1.24 NCCOC1=CC(Cl)=CC=C1 BBL008277 [1,1,0,0,0,0|1,0,0]=3 71 B11R1.157 CC1=CC(NC(N)=S)=CC=C1 BBL023549 [1,1,0,0,0,0|1,0,1]=4 72 B11R1.157 NC(=O)CC1=CC=CC(N)=C1 BBL032017 [1,1,0,0,0,0|1,0,1]=4 73 B11R1.192 NCCC1=CC(O)=C(O)C=C1 BBL013043 [1,1,0,0,0,0|1,0,0]=3 74 B11R1.37 CCC1=CC(Br)=CC=C1NN BBL022196 [1,1,0,0,0,0|2,0,0]=4 75 B11R1.37 COC1=C(C=O)C=CC(C)=C1 BBL034934 [1,1,0,0,0,0|1,0,1]=4 76 B11R1.37 COC1=CC=C(Cl)C=C1NN BBL022206 [1,1,0,0,0,0|2,0,0]=4 77 B11R1.37 COC1=CC=C(I)C=C1OC BBL034724 [1,1,0,0,0,0|2,0,0]=4 78 B11R1.280 COC1=CC(CO)=CC=C1O BBL008880 [1,1,0,0,0,0|2,0,0]=4 79 B11R1.230 CC1=CC(C)=NN1CCCN BBL038007 [0,1,0,0,1,0|2,0,0]=4 80 B11R1.598 CC1=NN(C)C(C)=C1CCN BBL030687 [0,1,0,0,1,0|2,0,0]=4 81 B11R1.645 CC1=NN(C)C=C1CC(C)N BBL038049 [0,1,0,0,1,0|2,0,0]=4 82 B11R1.465 CC1=NOC(C)=C1CCCN BBL023650 [0,1,0,0,1,0|2,0,0]=4 83 B13R1.3089 COC1=CC=C(C)C=C1CC(=O)O BBL020368 [0,2,0,0,0,0|1,0,1]=4 84 B13R1.257 CC1=CC(S(=O)(=O)NN)=C(C)C=C1 BBL013855 [0,2,0,0,0,0|2,0,0]=4 85 B13R1.893 CC1=CC(OCC(=O)O)=C(C)C=C1 BBL023636 [0,2,0,0,0,0|1,0,1]=4 86 B11R2.106 CC1=CC=CC2=C1C=CN2 BBL027536 [1,0,0,1,0,0|0,0,2]=4 87 B11R2.36 CC1=CC2=C(C=C1)NC=C2 BBL011007 [1,0,0,1,0,0|0,0,2]=4 88 B13R2.57 NCC1=CC2=C(C=C1)OCCC2 BBL034410 [0,1,0,1,0,0|2,0,0]=4 89 B13R2.43 CC1=CC=C2N=C(CN)NC2=C1 BBL009840 [0,1,0,1,0,0|1,0,1]=4 90 B13R2.369 NC1=C(O)C=C2CCCCC2=C1 BBL028254 [0,1,0,1,0,0|2,0,0]=4 91 B9R1.33 CC1=CC=NN1CCN BBL030322 [1,0,0,0,1,0|2,0,0]=4 92 B9R1.33 CC1=NC=CN1CCN BBL022416 [1,0,0,0,1,0|2,0,0]=4 93 B9R1.7 CC1=CSC(CCN)=N1 BBL011116 [1,0,0,0,1,0|2,0,0]=4 94 B9R1.7 CC1=NN(CCN)C=C1 BBL029476 [1,0,0,0,1,0|2,0,0]=4 95 B9R1.27 CC1=NNC(C)=C1CN BBL014299 [1,0,0,0,1,0|2,0,0]=4