0 B13R2.4825 CN1C(=O)CC2=C1C=CC=C2N AC8496 [0,0,0,0,0,0|3,0,0]=3 1 B13R2.4825 C[C@@H]1C(=O)NC2=C(Br)C=CC=C21 D72111 [0,0,0,0,0,0|2,1,0]=3 2 B12R2.18 CN1C(=O)NC2=C1N=CC=N2 D74841 [1,0,0,0,0,0|3,0,0]=4 3 B12R2.18 O=C1NC2=C(N=CC=C2)C1=O C14907 [1,0,0,0,0,0|2,0,1]=4 4 B12R2.18 [2H]C1=CC2=C(C=CC=C2)N1C AC6975 [1,0,0,0,0,0|3,0,0]=4 5 B12R2.196 FC1=CN=CC2=C1NC=C2Br 89151 [1,0,0,0,0,0|3,0,0]=4 6 B12R2.196 [2H]C1=CC=CC2=C1C=CN2C AC5544 [1,0,0,0,0,0|3,0,0]=4 7 B12R2.202 CC1=CC2=CC=CC(F)=C2N1 AT16035 [1,0,0,0,0,0|2,0,0]=3 8 B12R2.202 ClC1=NC2=C(Br)C=CC=C2N1 79223 [1,0,0,0,0,0|1,1,1]=4 9 B12R2.202 FC1=CC=CC2=C1OC(Cl)=N2 AC4467 [1,0,0,0,0,0|2,0,1]=4 10 B12R2.202 O=C1CC2=C(C=CN=C2Br)N1 D72986 [1,0,0,0,0,0|2,1,0]=4 11 B12R2.202 O=C1CC2=C(C=CN=C2Cl)N1 P19236 [1,0,0,0,0,0|2,1,0]=4 12 B12R2.202 O=C1CC2=C(C=CN=C2F)N1 D72987 [1,0,0,0,0,0|2,0,0]=3 13 B12R2.202 O=C1CC2=C(Cl)C=NC=C2N1 D72976 [1,0,0,0,0,0|2,1,0]=4 14 B12R2.202 O=C1CC2=C(F)C=NC=C2N1 D72975 [1,0,0,0,0,0|2,0,0]=3 15 B12R2.202 O=C1CC2=C(N1)C(Br)=NC=C2 D72980 [1,0,0,0,0,0|2,1,0]=4 16 B12R2.202 O=C1CC2=C(N1)C(F)=NC=C2 D72981 [1,0,0,0,0,0|2,0,0]=3 17 B14R2.4220 CC1=C(C=O)C2=CC=CC(F)=C2N1 AT15905 [0,1,0,0,0,0|2,0,1]=4 18 B12R1.225 CC(=O)[C@H](N)C1=CC=CC(F)=C1 D85231 [0,0,1,0,0,0|3,0,0]=4 19 B14R2.28472 CC1=CC2=CC=CC(Br)=C2NC1=O D73563 [0,0,0,0,0,1|2,1,0]=4 20 B14R2.28472 CC1=CC=CC2=C1NC(=O)C(=O)N2 F31282 [0,0,0,0,0,1|2,0,1]=4 21 B14R2.28472 CN1CC2=CC=CC(Br)=C2CC1=O AT25839 [0,0,0,0,0,1|2,1,0]=4 22 B11R1.40 CNC(=O)NC1=CC=CC=C1 D77088 [1,0,1,0,0,0|1,0,0]=3 23 B11R1.86 O=C(O)CC1=C(F)C=NC=C1 AT23311 [1,0,1,0,0,0|2,0,0]=4 24 B11R1.86 O=C(O)CC1=CC=CN=C1F AT23305 [1,0,1,0,0,0|2,0,0]=4 25 B11R2.106 FC1=C2NC=CC2=NC=C1 P12372 [2,0,0,0,0,0|2,0,0]=4 26 B13R1.202 O=C(O)C(=O)CC1=C(F)C=CC=C1 C91157 [0,1,1,0,0,0|2,0,0]=4 27 B13R2.45 O=CC1=C(I)C2=C(C=CC=C2)N1 W19263 [1,1,0,0,0,0|2,0,0]=4 28 B13R2.5190 CC1=CC2=C(C=C1)[C@H](N)C(=O)N2 W10069 [1,1,0,0,0,0|2,0,0]=4 29 B13R2.5190 CN1C(=O)NC2=C1C=CC(N)=C2 C75569 [1,1,0,0,0,0|1,0,0]=3 30 B13R2.54 O=CC1=CC2=CN=CC(F)=C2N1 P20168 [1,1,0,0,0,0|2,0,0]=4 31 B13R2.581 NCC1=CC=CC2=C1NC(=O)C2 95294 [1,1,0,0,0,0|2,0,0]=4 32 B13R2.581 NCC1=CC=CC2=C1NC(=O)C2 AT26796 [1,1,0,0,0,0|2,0,0]=4 33 B13R2.3050 O=C1CC2=C(N1)C(F)=C(Br)C=C2 P14761 [1,1,0,0,0,0|1,0,0]=3 34 B13R2.5139 FC1=C2N=C(Br)NC2=C(Br)C=C1 D80093 [1,1,0,0,0,0|1,0,1]=4 35 B13R2.5397 CC1=CC(C)=NC2=C1NC(=O)N2 D75132 [1,1,0,0,0,0|2,0,0]=4 36 B13R2.5397 CC1=CC2=C(F)C=C(Cl)C=C2N1 D76387 [1,1,0,0,0,0|2,0,0]=4 37 B13R2.5397 [BH3-]C1=CC(Cl)=C2NC(=O)CC2=C1 AC8887 [1,1,0,0,0,0|1,1,0]=4 38 B13R2.5397 [BH3-]C1=CC2=C(NC(=O)C2)C(C)=C1 AC8478 [1,1,0,0,0,0|2,0,0]=4 39 B15R2.63924 CN1C(=O)CCC2=C1C=CC(Br)=C2F 98503 [0,1,0,0,0,1|2,0,0]=4 40 B15R2.65672 CC1(C)C(=O)NC2=C(F)C=C(Br)C=C21 51740 [0,2,0,0,0,0|2,0,0]=4 41 B15R2.22370 COC1=C(F)C2=C(C=C1)C(=O)C(=O)N2 94820 [0,2,0,0,0,0|1,0,1]=4 42 B11R2.468 O=C1CC2=CC=CC(Br)=C12 AT20401 [1,0,0,0,1,0|1,1,0]=4 43 B13R2.5179 OC1=CC=C2C(F)=CC=CC2=N1 D71270 [1,0,0,0,0,1|2,0,0]=4