0 B10R1.17 CNCCC1=CC=CC=N1 BCP13129 [0,0,0,0,0,0|3,0,0]=3 1 B10R1.17 CNCCC1=CC=CC=N1 BCP13779 [0,0,0,0,0,0|3,0,0]=3 2 B10R1.17 CNCCC1=NC=CC=C1 BCP16849 [0,0,0,0,0,0|3,0,0]=3 3 B9R1.8 BrCCC1=CC=CN=C1 BCP07727 [1,0,0,0,0,0|2,0,0]=3 4 B9R1.8 ONCC1=CC=CC=C1 BCP07876 [1,0,0,0,0,0|1,0,0]=2 5 B11R1.1 ClC1=CC=C(OCCO)C=C1 BCP11228 [0,1,0,0,0,0|1,0,0]=2 6 B11R1.1 OC1=CC=C(CCNC)C=C1 BCP10171 [0,1,0,0,0,0|2,0,0]=3 7 B11R1.16 C[C@@H](N=C=O)C1=CC=CC=C1 BCP08224 [0,1,0,0,0,0|1,0,2]=4 8 B11R1.16 ClCC[C](c1ccccc1)O BCP12491 [0,1,0,0,0,0|1,0,1]=3 9 B11R1.16 O=C(CNC)C1=CC=CC=C1 BCP11464 [0,1,0,0,0,0|2,0,1]=4 10 B11R1.16 O[C](C1=CC=CC=C1)CCCl BCP15449 [0,1,0,0,0,0|1,0,1]=3 11 B11R1.17 OC1=C(OCCO)C=CC=C1 BCP18969 [0,1,0,0,0,0|1,0,0]=2 12 B11R1.28 BrCCCCC1=CC=CC=C1 BCP10383 [0,1,0,0,0,0|1,0,0]=2 13 B11R1.28 C1=C(CCCCO)C=CC=C1 BCP16469 [0,1,0,0,0,0|0,0,0]=1 14 B11R1.28 ClCCCCC1=CC=NC=C1 BCP12323 [0,1,0,0,0,0|2,0,0]=3 15 B11R1.28 NCCSSC1=NC=CC=C1 BCP08070 [0,1,0,0,0,0|3,0,0]=4 16 B11R1.28 OCCOCC1=CC=CC=C1 BCP19562 [0,1,0,0,0,0|0,0,0]=1 17 B11R1.40 OC[C@@H](N)CC1=CC=CC=C1 BCP17030 [0,1,0,0,0,0|0,0,0]=1 18 B11R2.1 NC1CCC2=C1C=CC=C2 BCP04726 [0,0,0,1,0,0|1,0,0]=2 19 B11R2.1 N[C@@H]1C2=C(CC1)C=CC=C2 BCP15509 [0,0,0,1,0,0|1,0,0]=2 20 B11R2.1 N[C@@H]1CCC2=C1C=CC=C2 BCP14221 [0,0,0,1,0,0|1,0,0]=2 21 B11R2.1 N[C]1CCC2=CC=CC=C21 BCP15726 [0,0,0,1,0,0|1,0,1]=3 22 B11R2.1 O=C1C2=C(CC1)C=CC=C2 BCP19847 [0,0,0,1,0,0|0,0,2]=3 23 B11R2.1 O=C1COc2c1cccc2 BCP07835 [0,0,0,1,0,0|1,0,2]=4 24 B11R2.20 C12=C(N=CC=C1)CCCC2 BCP10417 [0,0,0,1,0,0|2,0,0]=3 25 B11R2.20 C12=C(N=CC=C1)CCNC2 BCP08024 [0,0,0,1,0,0|3,0,0]=4 26 B11R2.20 C12=CC=NC=C1CNCC2 BCP14718 [0,0,0,1,0,0|3,0,0]=4 27 B11R2.20 N1=CC=CC2=C1CCNC2 BCP06160 [0,0,0,1,0,0|3,0,0]=4 28 B11R2.238 [C@@H]1(CC2=CC=CC=C2)NC1 BCP18628 [0,0,0,1,0,0|1,0,0]=2 29 B8R1.2 NCC1=CC=CN=C1 BCP13872 [2,0,0,0,0,0|2,0,0]=4 30 B8R1.2 OCC1=CC=CN=C1 BCP20084 [2,0,0,0,0,0|1,0,0]=3 31 B8R1.2 OCC1=CN=CN=C1 BCP04747 [2,0,0,0,0,0|2,0,0]=4 32 B8R1.2 [Na]SC1=CC=CC=C1 BCP14418 [2,0,0,0,0,0|2,0,0]=4 33 B10R0.71 CC\C=CC\C=CCCCO BCP13035 [0,1,1,0,0,0|0,0,2]=4 34 B10R1.1 ClC1=CC=C(CCBr)C=C1 BCP09513 [1,1,0,0,0,0|1,0,0]=3 35 B10R1.1 FC1=CC=C(CCBr)C=C1 BCP15339 [1,1,0,0,0,0|1,0,0]=3 36 B10R1.15 OC(CN)C1=CC=CN=C1 BCP11465 [1,1,0,0,0,0|2,0,0]=4 37 B10R1.18 C1=NC=CC=C1CC(O)=O BCP20278 [1,1,0,0,0,0|1,0,1]=4 38 B10R1.18 CC(=O)Cc1ccncc1 BCP13413 [1,1,0,0,0,0|1,0,1]=4 39 B10R1.18 CC(NC1=CC=CC=C1)=O BCP02363 [1,1,0,0,0,0|1,0,1]=4 40 B10R1.18 NC(CC1=CC=CC=C1)=O BCP10408 [1,1,0,0,0,0|0,0,2]=4 41 B10R1.18 OC(=O)Cc1ccncc1 BCP05255 [1,1,0,0,0,0|1,0,1]=4 42 B10R1.66 O=C(O)CCC1=CSC=C1 BCP20489 [0,1,0,0,1,0|1,0,1]=4 43 B12R1.16 OC(CNC)C1=CC=C(O)C=C1 BCP13680 [0,2,0,0,0,0|2,0,0]=4 44 B12R1.69 OC1=CC(O)=CC=C1CCCC BCP08128 [0,2,0,0,0,0|1,0,0]=3 45 B12R1.17 OC1=CC(C(CNC)O)=CC=C1 BCP19493 [0,2,0,0,0,0|2,0,0]=4 46 B12R1.17 O[C@@H](CNC)C1=CC(O)=CC=C1 BCP23410 [0,2,0,0,0,0|2,0,0]=4 47 B12R1.107 N[C@@H](CC(O)=O)C1=CC=CC=C1 BCP13904 [0,2,0,0,0,0|0,0,1]=3 48 B12R1.107 N[C](c1ccccc1)CC(=O)O BCP12759 [0,2,0,0,0,0|0,0,2]=4 49 B12R1.121 COC1=C(OCCN)C=CC=C1 BCP12481 [0,2,0,0,0,0|2,0,0]=4 50 B12R1.226 BrC1=CC(CCC(O)=O)=CC=C1 BCP15306 [0,2,0,0,0,0|0,0,1]=3 51 B12R1.226 C1=C(C=CC=C1CCC(O)=O)Cl BCP04483 [0,2,0,0,0,0|0,0,1]=3 52 B12R1.8 BrCCCOCc1ccccc1 BCP20136 [0,2,0,0,0,0|1,0,0]=3 53 B12R1.27 O=C(CCC1=CC=CC=C1)CBr BCP00253 [0,2,0,0,0,0|1,0,0]=3 54 B12R1.27 O=C(OCC1=CC=CC=C1)CO BCP10145 [0,2,0,0,0,0|0,0,1]=3 55 B12R1.252 O=C(O)CCCC1=CC=CC=C1 BCP10715 [0,2,0,0,0,0|0,0,0]=2 56 B12R1.43 N[C](CC1=CC=CC=C1)C(O)=O BCP16807 [0,2,0,0,0,0|0,0,2]=4 57 B10R2.6 [C]1(C2=CC=CC=C2)OC1 BCP14534 [1,0,0,1,0,0|0,0,1]=3 58 B10R2.7 C12=C(CNC1)C=CC=C2 BCP01139 [1,0,0,1,0,0|1,0,0]=3 59 B10R2.7 C12=C(CNC1)C=CC=C2 BCP15681 [1,0,0,1,0,0|1,0,0]=3 60 B10R2.7 C=12C=CC=CC1OBO2 BCP15959 [1,0,0,1,0,0|2,0,0]=4 61 B10R2.7 C=12C=CC=CC1OCO2 BCP11873 [1,0,0,1,0,0|1,0,0]=3 62 B10R2.7 C=12C=CC=NC1CNC2 BCP14712 [1,0,0,1,0,0|2,0,0]=4 63 B10R2.7 c1cnc2c(c1)CCC2 BCP01061 [1,0,0,1,0,0|1,0,0]=3 64 B10R2.32 OC1C2=NC=CN2CC1 BCP15379 [0,0,0,1,1,0|2,0,0]=4 65 B12R2.24 BrC1=CC2=C(C=C1)CCNC2 BCP10139 [0,1,0,1,0,0|2,0,0]=4 66 B12R2.24 BrC1=CC2=C(CNCC2)C=C1 BCP07129 [0,1,0,1,0,0|2,0,0]=4 67 B12R2.24 BrC1=CC2=C(CNCC2)C=C1 BCP10140 [0,1,0,1,0,0|2,0,0]=4 68 B12R2.24 BrC1=CC=C2OCCNC2=C1 BCP10058 [0,1,0,1,0,0|1,0,0]=3 69 B12R2.24 C1=C2COCCC2=CC(=C1)Br BCP08491 [0,1,0,1,0,0|2,0,0]=4 70 B12R2.24 CC1COC2=C(C=CC=C2)N1 BCP14442 [0,1,0,1,0,0|1,0,0]=3 71 B12R2.24 ClC1=CC=C2C(CCCC2)=N1 BCP09297 [0,1,0,1,0,0|2,0,0]=4 72 B12R2.24 OC1=CC2=C(C=C1)OCCO2 BCP02986 [0,1,0,1,0,0|1,0,0]=3 73 B12R2.24 OC1=CC=2NCCCC2C=C1 BCP13852 [0,1,0,1,0,0|1,0,0]=3 74 B12R2.24 OC1=CC=C2CCCCC2=C1 BCP20248 [0,1,0,1,0,0|1,0,0]=3 75 B12R2.132 O=C1C2=C(CC1)C=CC(F)=C2 BCP04453 [0,1,0,1,0,0|0,0,2]=4 76 B12R2.132 O=C1CCC2=C1C=C(Br)C=C2 BCP16277 [0,1,0,1,0,0|0,0,2]=4 77 B12R2.22 O=C1CC(C1)C2=CC=CC=C2 BCP20138 [0,1,0,1,0,0|0,0,2]=4 78 B12R2.116 NC1(C2=CC=CC=C2)CCC1 BCP10073 [0,1,0,1,0,0|1,0,0]=3 79 B12R2.1081 BrC1=C2C(OCCO2)=NC=C1 BCP14565 [0,1,0,1,0,0|2,0,0]=4 80 B12R2.1081 CC1C2=C(C=CC=C2)CCN1 BCP14751 [0,1,0,1,0,0|1,0,0]=3 81 B12R2.1081 NC1=C2OCCOC2=CC=C1 BCP11255 [0,1,0,1,0,0|1,0,0]=3 82 B12R2.1081 NC1C2=NC=CC=C2CCC1 BCP13456 [0,1,0,1,0,0|2,0,0]=4 83 B12R2.1081 O=C1C=2C=NC=CC2CCC1 BCP12803 [0,1,0,1,0,0|1,0,1]=4 84 B12R2.1081 O=C1CCCC2=C1C=NC=C2 BCP08935 [0,1,0,1,0,0|1,0,1]=4 85 B12R2.1081 O=C1CCNC2=C1C=CC=C2 BCP10083 [0,1,0,1,0,0|0,0,2]=4 86 B12R2.1081 O=C1CCOC2=C1C=CC=C2 BCP06538 [0,1,0,1,0,0|0,0,1]=3 87 B12R2.612 Cc1ccc2c(c1)CCC2=O BCP09170 [0,1,0,1,0,0|0,0,2]=4 88 B12R2.612 O=C1C2=CC=C(Br)C=C2CC1 BCP04452 [0,1,0,1,0,0|0,0,2]=4 89 B12R2.612 OB1OCC2=CC(Cl)=CC=C21 BCP16819 [0,1,0,1,0,0|2,0,0]=4 90 B12R2.612 OB1OCC2=CC(F)=CC=C21 BCP08730 [0,1,0,1,0,0|2,0,0]=4 91 B12R2.1 OCC1=CNC2=C1C=CC=C2 BCP00087 [0,1,0,1,0,0|0,0,2]=4 92 B12R2.18 N[C@@H]1[C](O)Cc2c1cccc2 BCP01236 [0,1,0,1,0,0|1,0,1]=4 93 B12R2.18 O[C@@H]1[C](N)C2=C(C=CC=C2)C1 BCP01235 [0,1,0,1,0,0|1,0,1]=4