0 B13R2.3028 CN1C(=O)NC2=C1N=C(Br)C=N2 D76744 [0,0,0,0,0,0|3,1,0]=4 1 B13R2.3028 CN1C(Cl)=NC2=C1C=C(Cl)C=C2 E72598 [0,0,0,0,0,0|2,1,1]=4 2 B13R2.3028 O=C1SC2=C(C=C(Cl)C=C2)C1=O AT25623 [0,0,0,0,0,0|2,1,1]=4 3 B12R2.18 CN1C(=O)NC2=C1N=CC=N2 D74841 [1,0,0,0,0,0|3,0,0]=4 4 B12R2.18 O=C1NC2=C(N=CC=C2)C1=O C14907 [1,0,0,0,0,0|2,0,1]=4 5 B12R2.18 [2H]C1=CC2=C(C=CC=C2)N1C AC6975 [1,0,0,0,0,0|3,0,0]=4 6 B12R2.132 CC1=CNC2=C1C=C(N)C=C2 AT22652 [1,0,0,0,0,0|3,0,0]=4 7 B12R2.132 O[C@H]1COC2=C1C=C(F)C=C2 AT23851 [1,0,0,0,0,0|2,0,1]=4 8 B12R2.132 [2H]C1=CC2=C(C=C1)C=CN2C AC5657 [1,0,0,0,0,0|3,0,0]=4 9 B12R2.606 CC1=CC2=C(C=N1)CC(=O)N2 D72985 [1,0,0,0,0,0|3,0,0]=4 10 B12R2.606 NC1=CC2=C(C=N1)NC(=O)C2 D72978 [1,0,0,0,0,0|3,0,0]=4 11 B12R2.606 O=C1C=C2NC(=O)CC2=CN1 D72982 [1,0,0,0,0,0|3,0,0]=4 12 B12R2.606 O=C1NC2=C(C=C(O)C=C2)S1 AC8237 [1,0,0,0,0,0|2,0,0]=3 13 B14R2.8716 CN1C(=O)N(C)C2=C1C=CC(Br)=C2 AT10332 [0,1,0,0,0,0|1,1,0]=3 14 B12R1.225 CC(=O)[C@H](N)C1=CC=CC(F)=C1 D85231 [0,0,1,0,0,0|3,0,0]=4 15 B11R1.20 O=C(O)CC1=CN=C(F)C=C1 AT23306 [1,0,1,0,0,0|2,0,0]=4 16 B11R1.40 CNC(=O)NC1=CC=CC=C1 D77088 [1,0,1,0,0,0|1,0,0]=3 17 B13R2.45 O=CC1=C(I)C2=C(C=CC=C2)N1 W19263 [1,1,0,0,0,0|2,0,0]=4 18 B13R2.4825 CN1C(=O)CC2=C1C=CC=C2N AC8496 [1,1,0,0,0,0|2,0,0]=4 19 B13R2.4825 C[C@@H]1C(=O)NC2=C(Br)C=CC=C21 D72111 [1,1,0,0,0,0|2,0,0]=4 20 B13R2.5190 CC1=CC2=C(C=C1)[C@H](N)C(=O)N2 W10069 [1,1,0,0,0,0|2,0,0]=4 21 B13R2.5190 CN1C(=O)NC2=C1C=CC(N)=C2 C75569 [1,1,0,0,0,0|1,0,0]=3 22 B13R2.2121 COC1=CC2=C(C=C1)OC(=O)N2 AC6094 [1,1,0,0,0,0|2,0,0]=4 23 B13R2.2121 O=C1CC2=C(C=C(CO)C=C2)N1 AT22550 [1,1,0,0,0,0|2,0,0]=4 24 B13R2.2121 O=CC1=CC2=C(C=C1)CC(=O)N2 D75814 [1,1,0,0,0,0|2,0,0]=4 25 B13R2.2121 O=CC1=CC2=C(C=C1)NC(=O)C2 AT23768 [1,1,0,0,0,0|2,0,0]=4 26 B13R2.3050 O=C1CC2=C(N1)C(F)=C(Br)C=C2 P14761 [1,1,0,0,0,0|1,1,0]=4 27 B13R2.5397 CC1=CC(C)=NC2=C1NC(=O)N2 D75132 [1,1,0,0,0,0|2,0,0]=4 28 B13R2.5397 [BH3-]C1=CC(Cl)=C2NC(=O)CC2=C1 AC8887 [1,1,0,0,0,0|2,0,0]=4 29 B13R2.5397 [BH3-]C1=CC2=C(NC(=O)C2)C(C)=C1 AC8478 [1,1,0,0,0,0|2,0,0]=4 30 B13R2.13083 CC1=C(Br)C=C2NC(=O)NC2=N1 C91914 [1,1,0,0,0,0|1,1,0]=4 31 B15R2.13981 CN1C(=O)CCC2=CC(Br)=C(F)C=C21 C91784 [0,1,0,0,0,1|2,0,0]=4 32 B15R2.13973 O=C1NC2=C(C=C(F)C=C2)S(=O)(=O)N1 D75301 [0,1,0,0,0,1|1,0,1]=4 33 B15R2.7204 CC1=C(C(=O)O)C2=C(C=CC(F)=C2)N1 AT26651 [0,2,0,0,0,0|2,0,0]=4 34 B13R2.3683 O=C1COC2=C(C=CC(O)=C2)N1 AT20434 [0,0,1,1,0,0|2,0,0]=4 35 B13R2.369 NC1=CC2=C(C=CC=C2)NC1=O AC9491 [1,0,0,0,0,1|2,0,0]=4 36 B15R2.61992 CN1CC(=O)NC2=C(C=C(Cl)C=C2)C1 E71308 [0,0,0,0,0,2|1,1,0]=4