0 B9R1.22 C#CC1=CN(C)N=C1C B051077 [0,0,0,0,0,0|2,0,2]=4 1 B9R1.22 C(=O)C1=NC(Br)=NN1C B051984 [0,0,0,0,0,0|4,0,0]=4 2 B9R1.22 CC1=CC(C=O)=C(C)S1 B018517 [0,0,0,0,0,0|3,0,0]=3 3 B9R1.22 CC1=CN(C)C(C=O)=N1 B047108 [0,0,0,0,0,0|4,0,0]=4 4 B9R1.22 CC1=CN(C)N=C1C=O B047533 [0,0,0,0,0,0|4,0,0]=4 5 B9R1.22 CC1=NN(C)C(C#N)=C1 B019536 [0,0,0,0,0,0|3,0,1]=4 6 B9R1.22 CC1=NN(C)C(C=O)=C1 B015985 [0,0,0,0,0,0|3,0,0]=3 7 B9R1.22 CC1=NN(C)C(CCl)=C1 B036473 [0,0,0,0,0,0|3,0,1]=4 8 B9R1.22 CC1=NN(C)C(CN)=C1 B016070 [0,0,0,0,0,0|3,0,1]=4 9 B9R1.22 CC1=NN(C)C(CO)=C1 B036104 [0,0,0,0,0,0|3,0,1]=4 10 B9R1.22 CC1=NN(C)C(NN)=C1 B057217 [0,0,0,0,0,0|4,0,0]=4 11 B9R1.22 CC1=NN(C)C=C1C#N B019532 [0,0,0,0,0,0|3,0,1]=4 12 B9R1.22 CC1=NN(C)C=C1C=O B000370 [0,0,0,0,0,0|3,0,0]=3 13 B9R1.22 CC1=NN(C)C=C1CN B001001 [0,0,0,0,0,0|3,0,1]=4 14 B9R1.22 CC1=NN(C)C=C1CN B037095 [0,0,0,0,0,0|3,0,1]=4 15 B9R1.22 CC1=NN(C)C=C1CO B000988 [0,0,0,0,0,0|3,0,1]=4 16 B9R1.22 CN1C=C(C=O)C(Br)=N1 B059872 [0,0,0,0,0,0|4,0,0]=4 17 B9R1.22 CN1C=C(C=O)C(I)=N1 B059893 [0,0,0,0,0,0|4,0,0]=4 18 B8R1.1 C(=O)C1=CC=C(F)S1 B039130 [1,0,0,0,0,0|3,0,0]=4 19 B8R1.1 CC1=CC=C(C=O)S1 B015983 [1,0,0,0,0,0|2,0,0]=3 20 B8R1.1 CC1=CC=C(CN)S1 B030516 [1,0,0,0,0,0|2,0,1]=4 21 B8R1.1 CC1=NN=C(NN)S1 B050450 [1,0,0,0,0,0|3,0,0]=4 22 B8R1.1 CC1=NNC(C=O)=C1 B014001 [1,0,0,0,0,0|3,0,0]=4 23 B8R1.1 CN1C=C(C=O)C=N1 B000400 [1,0,0,0,0,0|3,0,0]=4 24 B8R1.1 O=CC1=CC=C(Cl)S1 B022480 [1,0,0,0,0,0|3,0,0]=4 25 B8R1.1 O=CC1=CN=C(Cl)S1 B030507 [1,0,0,0,0,0|2,0,0]=3 26 B8R1.11 C(=O)C1=NC=NN1C B052001 [1,0,0,0,0,0|3,0,0]=4 27 B8R1.11 CC1=C(CBr)SC=N1 B059808 [1,0,0,0,0,0|1,0,1]=3 28 B8R1.11 CC1=C(CN)SN=N1 B037979 [1,0,0,0,0,0|2,0,1]=4 29 B8R1.11 CC1=C(CO)SC=N1 B059809 [1,0,0,0,0,0|1,0,1]=3 30 B8R1.11 CC1=C(CO)SN=N1 B037631 [1,0,0,0,0,0|2,0,1]=4 31 B8R1.11 CN1N=CC=C1C=O B007393 [1,0,0,0,0,0|3,0,0]=4 32 B8R1.18 CC1=NN(C)C(F)=C1 B051212 [1,0,0,0,0,0|3,0,0]=4 33 B8R1.18 CC1=NN(C)C(N)=C1 B024294 [1,0,0,0,0,0|3,0,0]=4 34 B8R1.18 CC1=NN(C)C(N)=C1 B051584 [1,0,0,0,0,0|3,0,0]=4 35 B8R1.18 CC1=NN(C)C=C1Br B019512 [1,0,0,0,0,0|3,0,0]=4 36 B8R1.18 CC1=NN(C)C=C1Cl B039711 [1,0,0,0,0,0|3,0,0]=4 37 B8R1.18 CC1=NN(C)C=C1I B047730 [1,0,0,0,0,0|3,0,0]=4 38 B8R1.18 CC1=NN(C)C=C1N B006417 [1,0,0,0,0,0|3,0,0]=4 39 B8R1.18 CC1=NN(C)C=C1N B029435 [1,0,0,0,0,0|3,0,0]=4 40 B10R1.35 CCN1C=C(C=O)C(C)=N1 B000391 [0,1,0,0,0,0|3,0,0]=4 41 B10R1.59 CC(=O)C1=CC(C)=NN1C B018730 [0,1,0,0,0,0|2,0,1]=4 42 B10R1.59 CC(=O)C1=CN(C)N=C1C B007420 [0,1,0,0,0,0|2,0,1]=4 43 B10R1.59 CC1=C(C(=O)O)SC(N)=N1 B030024 [0,1,0,0,0,0|2,0,0]=3 44 B10R1.59 CC1=NN(C)C(C(=O)O)=C1 B013525 [0,1,0,0,0,0|3,0,0]=4 45 B10R1.59 CC1=NN(C)C=C1C(=O)Cl B011575 [0,1,0,0,0,0|3,0,0]=4 46 B10R1.59 CC1=NN(C)C=C1C(=O)O B000228 [0,1,0,0,0,0|3,0,0]=4 47 B10R1.130 CC1=NN(C)C=C1\C=N/O B000989 [0,1,0,0,0,0|3,0,0]=4 48 B10R1.256 C(=O)C1=C(F)N(C)N=C1C B051233 [0,1,0,0,0,0|3,0,0]=4 49 B10R1.256 CC1=NN(C)C(C)=C1C=O B006543 [0,1,0,0,0,0|3,0,0]=4 50 B10R1.256 CC1=NN(C)C(C=O)=C1Cl B046351 [0,1,0,0,0,0|3,0,0]=4 51 B7R1.1 ClCC1=CN=CS1 B059804 [2,0,0,0,0,0|1,0,1]=4 52 B7R1.1 NCC1=CN=CS1 B059797 [2,0,0,0,0,0|1,0,1]=4 53 B7R1.2 CC1=NN(C)C=C1 B006757 [2,0,0,0,0,0|2,0,0]=4 54 B9R1.21 C=CC1=CN(CC)N=C1 B051825 [1,1,0,0,0,0|2,0,0]=4 55 B9R1.21 CCC1=CC=C(C=O)S1 B003568 [1,1,0,0,0,0|2,0,0]=4 56 B9R1.21 COC1=NC=C(C=O)S1 B059779 [1,1,0,0,0,0|1,0,0]=3 57 B9R1.21 COC1=NC=C(CN)S1 B059781 [1,1,0,0,0,0|1,0,1]=4 58 B9R1.23 CC1=C(Br)C=C(C=O)S1 B003571 [1,1,0,0,0,0|2,0,0]=4 59 B9R1.33 CNCC1=C(C)N=CS1 B059739 [1,1,0,0,0,0|0,0,2]=4 60 B9R1.41 CC1=C(C(=O)Cl)SN=N1 B037485 [1,1,0,0,0,0|2,0,0]=4 61 B9R1.41 CC1=C(C(=O)O)SN=N1 B049290 [1,1,0,0,0,0|2,0,0]=4 62 B11R1.225 COC(=O)C1=C(C)N=C(N)S1 B000344 [0,2,0,0,0,0|1,0,1]=4 63 B9R1.69 CC1=NC(C)=C(N)C=C1 B049993 [0,0,1,1,0,0|2,0,0]=4 64 B9R1.69 CC1=NC(C)=C(O)C=C1 B049973 [0,0,1,1,0,0|2,0,0]=4