0 B14R2.19 NC1=CN(CC2=CC=CC=C2)C=N1 SC-26313 [0,0,0,0,0,0|3,0,1]=4 1 B14R2.19 NC1=CN(CC2=CC=CC=C2)N=C1 SC-43574 [0,0,0,0,0,0|4,0,0]=4 2 B14R2.19 NC1=NC(CC2=CC=CC=C2)=NO1 SC-34286 [0,0,0,0,0,0|1,0,1]=2 3 B14R2.19 NC1=NOC(CC2=CC=CC=C2)=N1 SC-34053 [0,0,0,0,0,0|2,0,1]=3 4 B14R2.19 O=C1CCN(CC2=CC=CC=C2)C1 SC-25251 [0,0,0,0,0,0|4,0,0]=4 5 B14R2.19 O=C1N[C@@H](CC2=CC=CC=C2)CO1 SC-19534 [0,0,0,0,0,0|1,0,1]=2 6 B14R2.19 S=C1N[C@@H](CC2=CC=CC=C2)CO1 SC-65525 [0,0,0,0,0,0|1,0,1]=2 7 B14R2.19 S=C1N[C@H](CC2=CC=CC=C2)CO1 SC-14154 [0,0,0,0,0,0|1,0,1]=2 8 B13R2.64 C1=CC=C(CC2CCNC2)C=C1 SC-50777 [1,0,0,0,0,0|2,0,1]=4 9 B15R2.98 NC1=NC(CC2=CC=C(Br)C=C2)=NO1 SC-34147 [0,1,0,0,0,0|1,0,1]=3 10 B15R2.98 NC1=NC(CC2=CC=C(Cl)C=C2)=NO1 SC-33810 [0,1,0,0,0,0|1,0,1]=3 11 B15R2.98 NC1=NC(CC2=CC=C(F)C=C2)=NO1 SC-52100 [0,1,0,0,0,0|1,0,1]=3 12 B15R2.98 NC1=NN(CC2=CC=C(Cl)C=C2)C=C1 SC-52037 [0,1,0,0,0,0|2,0,1]=4 13 B15R2.98 NC1=NOC(CC2=CC=C(F)C=C2)=N1 SC-35004 [0,1,0,0,0,0|2,0,1]=4 14 B15R2.314 CN1C=C(CC2=CC=CC=C2)N=C1N SC-31279 [0,1,0,0,0,0|1,0,2]=4 15 B15R2.325 CC1=CC(N)=NN1CC2=CC=CC=C2 SC-66465 [0,1,0,0,0,0|2,0,1]=4 16 B13R1.337 N=C(N)NCCCC1=CC=CC=C1 SC-60373 [0,0,1,0,0,0|1,0,0]=2 17 B13R1.337 O=C(Cl)OCCOC1=CC=CC=C1 SC-86178 [0,0,1,0,0,0|3,0,0]=4 18 B13R1.348 CC(CC(=O)O)CC1=CC=CC=C1 SC-87963 [0,0,1,0,0,0|2,0,0]=3 19 B13R1.348 NC(CC(=O)O)CC1=CC=CC=C1 SC-12427 [0,0,1,0,0,0|3,0,0]=4 20 B13R1.348 NC(CC(=O)O)CC1=CC=CC=C1 SC-43726 [0,0,1,0,0,0|3,0,0]=4 21 B13R1.718 COC(=O)CCNC1=CC=CC=C1 SC-48391 [0,0,1,0,0,0|3,0,0]=4 22 B13R2.10 BrC1=NC(C2=CC=CC=C2)=NO1 SC-53031 [0,0,0,0,1,0|2,0,1]=4 23 B13R2.10 NC1=CC(C2=CC=CC=C2)=NO1 SC-70308 [0,0,0,0,1,0|2,0,1]=4 24 B13R2.10 NC1=CSC(C2=CC=CC=C2)=N1 SC-72044 [0,0,0,0,1,0|2,0,1]=4 25 B13R2.10 NC1=NSC(C2=CC=CC=C2)=N1 SC-13955 [0,0,0,0,1,0|2,0,1]=4 26 B13R2.10 O=C1NCC(C2=CC=CC=C2)N1 SC-89145 [0,0,0,0,1,0|2,0,1]=4 27 B13R2.10 O=C1NCC(C2=CC=CC=C2)O1 SC-49190 [0,0,0,0,1,0|3,0,0]=4 28 B13R2.10 S=C1N[C@@H](C2=CC=CC=C2)CO1 SC-17369 [0,0,0,0,1,0|1,0,1]=3 29 B13R2.10 [C@@H]1(C2=CC=CC=C2)COC(=S)N1 SC-25816 [0,0,0,0,1,0|1,0,1]=3 30 B13R2.10 [C@H]1(C2=CC=CC=C2)CSC(=S)N1 SC-17058 [0,0,0,0,1,0|1,1,1]=4 31 B13R2.31 O=C1CC(CC2=CC=CC=C2)C1 SC-36029 [0,0,0,0,1,0|2,0,0]=3 32 B15R2.31 O=C1CCNC(CC2=CC=CC=C2)C1 SC-35531 [0,0,0,0,0,1|3,0,0]=4 33 B12R1.8 O=CCCCCC1=CC=CC=C1 SC-68672 [1,0,1,0,0,0|2,0,0]=4 34 B12R1.118 CCC(CC1=CC=CC=C1)NN SC-38920 [1,0,1,0,0,0|1,0,1]=4 35 B12R1.118 CCC(CN)CC1=CC=CC=C1 SC-29497 [1,0,1,0,0,0|1,0,1]=4 36 B12R1.252 N=C(N)CCCC1=CC=CC=C1 SC-39290 [1,0,1,0,0,0|2,0,0]=4 37 B12R1.252 N=C(N)NCCC1=CC=CC=C1 SC-60341 [1,0,1,0,0,0|1,0,1]=4 38 B14R1.698 CC(CC1=CC=C(O)C=C1)NC(=O)O SC-60631 [0,1,1,0,0,0|1,0,1]=4 39 B14R1.13 COC(=O)CCCC1=CC=C(Br)C=C1 SC-50343 [0,1,1,0,0,0|2,0,0]=4 40 B14R2.20 NC1=NC(C2=CC=C(Cl)C=C2)=NO1 SC-29528 [0,1,0,0,1,0|1,0,1]=4 41 B14R2.20 NC1=NC(C2=CC=C(F)C=C2)=NO1 SC-34829 [0,1,0,0,1,0|1,0,1]=4 42 B16R2.11484 NC1=NC(CC2=C(Cl)C=CC=C2Cl)=NO1 SC-33648 [0,2,0,0,0,0|1,0,1]=4 43 B16R2.79318 NC1=NC(CC2=CC(F)=CC(F)=C2)=NO1 SC-32840 [0,2,0,0,0,0|1,0,1]=4 44 B14R2.68 O=C1CCC(C2=CC=CC=C2)CO1 SC-35883 [0,0,1,1,0,0|2,0,0]=4 45 B12R1.43 NC(=O)[C@@H](N)CC1=CC=CC=C1 SC-24697 [0,0,1,0,1,0|1,0,1]=4 46 B12R1.43 N[C@H](CC1=CC=CC=C1)C(=O)O SC-10967 [0,0,1,0,1,0|2,0,0]=4 47 B12R1.107 CC(NC(=N)N)C1=CC=CC=C1 SC-60359 [0,0,1,0,1,0|1,0,1]=4 48 B12R2.2058 C1=CC=C(CC2CNC2)C=C1 SC-42034 [1,0,0,0,1,0|1,0,1]=4 49 B12R2.22 N[C@H]1C[C@@H](C2=CC=CC=C2)C1 SC-87898 [0,0,0,0,2,0|1,0,1]=4 50 B14R2.101 C1=CC=C(CNC2CCOC2)C=C1 SC-59791 [1,0,0,0,0,1|1,0,1]=4