0 B12R1.34 O=C(OC)C(Br)C1=CC=CC=C1 M10050484P [0,0,0,0,0,0|3,0,1]=4 1 B12R1.34 O=C(OC)C(O)C1=CC=CC=C1 M10062314P [0,0,0,0,0,0|2,0,1]=3 2 B11R1.16 CC(C1=CC=CC=C1)CNC M12025375P [1,0,0,0,0,0|1,0,0]=2 3 B11R1.16 N#CCC(O)C1=CC=CC=C1 M10147841P [1,0,0,0,0,0|2,0,0]=3 4 B11R1.16 OC(C1=CC=CC=C1)CCCl M10157240P [1,0,0,0,0,0|2,0,0]=3 5 B11R1.16 OCCC(N)C1=CC=CC=C1 M10132113P [1,0,0,0,0,0|3,0,0]=4 6 B11R1.36 CC(C)C(C1=CC=CC=C1)=O M10015939P [1,0,0,0,0,0|0,0,2]=3 7 B11R1.36 CC(F)C(C1=CC=CC=C1)=O M10168847P [1,0,0,0,0,0|1,0,2]=4 8 B11R1.36 O=C(N(C)C)C1=CC=CC=C1 M10015943P [1,0,0,0,0,0|1,0,2]=4 9 B11R1.40 CCC(CC1=CC=CC=C1)=O M10025082P [1,0,0,0,0,0|2,0,1]=4 10 B13R1.21 OC1=CC=C([C@H](O)[C@H](NC)C)C=C1 M10009323P [0,1,0,0,0,0|0,0,0]=1 11 B13R1.86 CC(C1=CC=CC=C1)C(OC)OC M10002015P [0,1,0,0,0,0|2,0,0]=3 12 B10R1.15 BrCC(O)C1=CC=CC=C1 M10828430P [2,0,0,0,0,0|1,0,0]=3 13 B10R1.15 CC(C1=CC=CC=C1)CBr M10031082P [2,0,0,0,0,0|2,0,0]=4 14 B10R1.15 CC(C1=CC=CC=C1)CN M10165660P [2,0,0,0,0,0|1,0,0]=3 15 B10R1.15 CC(C1=CC=CC=C1)CO M10027348P [2,0,0,0,0,0|2,0,0]=4 16 B10R1.15 C[C@@H](NC)C1=CC=CC=C1 M10082047P [2,0,0,0,0,0|1,0,0]=3 17 B10R1.15 NC(CC)C1=CC=CC=C1 M10388570P [2,0,0,0,0,0|1,0,0]=3 18 B10R1.15 NCC(C)C1=CC=CC=C1 M10223405P [2,0,0,0,0,0|1,0,0]=3 19 B10R1.15 NCC(C1=CC=CC=C1)=O M10016076P [2,0,0,0,0,0|0,0,2]=4 20 B10R1.15 NCC(O)C1=CC=CC=C1 M10108745P [2,0,0,0,0,0|0,0,0]=2 21 B10R1.15 NCC(O)C1=CC=CN=C1 M11170969P [2,0,0,0,0,0|1,0,0]=3 22 B10R1.15 NC[C@H](O)C1=CC=CN=C1 M10096144P [2,0,0,0,0,0|1,0,0]=3 23 B10R1.15 N[C@@H](C1=CC=CC=C1)CO M10168325P [2,0,0,0,0,0|2,0,0]=4 24 B10R1.17 C=CCCC1=CC=CC=C1 M10020323P [2,0,0,0,0,0|1,0,1]=4 25 B10R1.17 CNCCC1=CC=CC=C1 M10060073P [2,0,0,0,0,0|0,0,0]=2 26 B10R1.17 CNCCC1=NC=CC=C1 M10024739P [2,0,0,0,0,0|1,0,0]=3 27 B10R1.17 [C-]#[N+]CCC1=CC=CC=C1 M10309731P [2,0,0,0,0,0|0,0,2]=4 28 B10R1.18 CC(O)CC1=CC=CC=C1 M10018807P [2,0,0,0,0,0|1,0,0]=3 29 B10R1.18 CC(O)CC1=CC=CC=C1 M10133834P [2,0,0,0,0,0|1,0,0]=3 30 B10R1.18 CC(OC1=CC=CC=C1)C M10047209P [2,0,0,0,0,0|1,0,0]=3 31 B10R1.18 C[C@@H](O)CC1=CC=CC=C1 M10032962P [2,0,0,0,0,0|1,0,0]=3 32 B10R1.18 C[C@H](O)CC1=CC=CC=C1 M10032105P [2,0,0,0,0,0|1,0,0]=3 33 B12R1.16 OC1=CC=C(C=C1)C(CNC)O M10143754P [1,1,0,0,0,0|0,0,0]=2 34 B12R1.17 CNCC(C1=CC=CC(O)=C1)=O M10621387P [1,1,0,0,0,0|0,0,2]=4 35 B12R1.17 OC1=CC(C(CNC)O)=CC=C1 M12028865P [1,1,0,0,0,0|0,0,0]=2 36 B12R1.17 OC1=CC=CC(C(O)CNC)=C1 M10005744P [1,1,0,0,0,0|0,0,0]=2 37 B12R1.17 OC1=CC=CC([C@@H](O)CNC)=C1 M10147645P [1,1,0,0,0,0|0,0,0]=2 38 B12R1.107 CN(C[C@@H](N)C1=CC=CC=C1)C M10942923P [1,1,0,0,0,0|1,0,0]=3 39 B12R1.225 OC1=CC=CC([C@H](N(C)C)C)=C1 M10999991P [1,1,0,0,0,0|2,0,0]=4 40 B12R1.478 CC(C)C(C1=CC=CC=C1)C#N M10077651P [1,1,0,0,0,0|1,0,0]=3 41 B12R1.564 CC(C)(C)C(C1=CC=CC=C1)N M10336790P [1,1,0,0,0,0|1,0,0]=3 42 B12R1.32 CN(CCO)CC1=CC=CC=C1 M10002949P [1,1,0,0,0,0|2,0,0]=4 43 B12R1.118 CCN(CC1=CC=CC=C1)CC M10020469P [1,1,0,0,0,0|2,0,0]=4 44 B12R1.118 OC[C@@H](NC)CC1=CC=CC=C1 M10499013P [1,1,0,0,0,0|0,0,0]=2 45 B12R2.2 C1(C2CNCC2)=NC=CC=C1 M10775501P [1,0,0,1,0,0|2,0,0]=4 46 B12R2.116 NC1(C2=CC=CC=C2)CCC1 M10149200P [1,0,0,1,0,0|2,0,0]=4 47 B12R2.116 OC1(C2=CC=CC=C2)CNC1 M10893489P [1,0,0,1,0,0|0,0,0]=2 48 B12R2.1081 ClC1CCCC2=C1C=CC=C2 M10686877P [1,0,0,1,0,0|2,0,0]=4 49 B12R2.1081 OC1CCCC2=C1C=CC=C2 M11193696P [1,0,0,1,0,0|1,0,0]=3 50 B12R2.18 OC1C(Br)CC2=C1C=CC=C2 M10072804P [1,0,0,1,0,0|1,0,0]=3 51 B12R2.18 O[C@@H]1[C@H](N)C2=C(C=CC=C2)C1 M10107049P [1,0,0,1,0,0|2,0,0]=4 52 B12R2.18 O[C@H]1[C@H](Br)CC2=C1C=CC=C2 M10114550P [1,0,0,1,0,0|1,0,0]=3 53 B12R2.24 CC1NC2=C(C=CC=C2)CC1 M10036158P [1,0,0,1,0,0|2,0,0]=4 54 B12R2.24 NC1CC2=C(C=CC=C2)CC1 M10049516P [1,0,0,1,0,0|2,0,0]=4 55 B14R2.21 OC1CC(C2=CC=CC=C2)OCC1 M10648546P [0,0,0,1,0,1|2,0,0]=4 56 B14R2.598 O=C1O[C@H](C2=CC=CC=C2)[C@H](C)N1 M10141652P [0,1,0,1,0,0|0,0,1]=3 57 B10R1.27 CC(NC)CC1=CC=CS1 M10106016P [1,0,0,0,1,0|1,0,0]=3