0 B13R2.32 CN1C(=O)NCC2=C1C=CC=C2 H-8618 [1,0,0,0,0,0|2,0,0]=3 1 B13R2.369 CC1=CC2=CC=CC=C2NC1=O H-8558 [1,0,0,0,0,0|1,0,2]=4 2 B13R2.369 CC1NC2=CC=CC=C2NC1=O C-2873 [1,0,0,0,0,0|2,0,0]=3 3 B13R2.369 NC1=CC2=C(C=CC=C2)OC1=O O31934 [1,0,0,0,0,0|1,0,2]=4 4 B13R2.369 NC1CC2=C(C=CC=C2)CC1O L20042 [1,0,0,0,0,0|1,0,2]=4 5 B13R2.369 O=C1NC2=CC=CC=C2C=C1Br N25822 [1,0,0,0,0,0|1,0,2]=4 6 B15R2.21243 CN1C(=O)C(CN)=CC2=CC=CC=C21 L20837 [0,1,0,0,0,0|1,0,2]=4 7 B15R2.63893 CN1CC2=CC(N)=CC=C2N(C)C1=O H-8390 [0,1,0,0,0,0|3,0,0]=4 8 B13R1.135 CNC(=O)[C@@H](N)CC1=CC=CC=C1 P40579 [0,0,1,0,0,0|1,0,0]=2 9 B13R1.135 CNC(=O)[C@H](N)CC1=CC=CC=C1 P42628 [0,0,1,0,0,0|1,0,0]=2 10 B13R1.135 COC(=O)C(N)CC1=NC=CC=C1 P43149 [0,0,1,0,0,0|3,0,0]=4 11 B13R1.696 CC1=CC=CC=C1N(C)C(=O)CN P43013 [0,0,1,0,0,0|1,0,0]=2 12 B13R2.3085 CN1C(=O)N(C)C2=CC=CC=C21 O30178 [0,0,0,0,1,0|3,0,0]=4 13 B12R1.371 CCC(=O)CC1=CC=CC=C1C P39216 [1,0,1,0,0,0|2,0,0]=4 14 B12R1.371 O=C(CCl)NC1=CC=CC=C1O Q69317 [1,0,1,0,0,0|2,0,0]=4 15 B12R1.27 NNC(=O)CCC1=CC=CC=C1 P38586 [1,0,1,0,0,0|1,0,0]=3 16 B12R1.43 CC(CC1=CC=CN=C1)C(=O)O P43046 [1,0,1,0,0,0|2,0,0]=4 17 B12R1.43 CC(CC1=CC=NC=C1)C(=O)O Q60576 [1,0,1,0,0,0|2,0,0]=4 18 B12R1.43 CC(CC1=NC=CC=C1)C(=O)O P43045 [1,0,1,0,0,0|2,0,0]=4 19 B12R1.43 C[C@H](OC1=CC=CC=C1)C(=O)O K12054 [1,0,1,0,0,0|2,0,0]=4 20 B12R1.43 NC(CC1=CN=CN=C1)C(=O)O Q63780 [1,0,1,0,0,0|2,0,0]=4 21 B12R1.43 N[C@@H](CC1=CC=CN=C1)C(=O)O P36885 [1,0,1,0,0,0|1,0,0]=3 22 B12R1.43 N[C@@H](CC1=CC=CN=C1)C(=O)O P43169 [1,0,1,0,0,0|1,0,0]=3 23 B12R1.43 N[C@@H](CC1=CC=NC=C1)C(=O)O P38459 [1,0,1,0,0,0|1,0,0]=3 24 B12R1.43 N[C@@H](CC1=CN=CN=C1)C(=O)O Q63782 [1,0,1,0,0,0|2,0,0]=4 25 B12R1.43 N[C@@H](CC1=NC=CC=C1)C(=O)O P38458 [1,0,1,0,0,0|1,0,0]=3 26 B12R1.43 N[C@H](CC1=CC=CN=C1)C(=O)O P36517 [1,0,1,0,0,0|1,0,0]=3 27 B12R1.43 N[C@H](CC1=CC=NC=C1)C(=O)O O27942 [1,0,1,0,0,0|1,0,0]=3 28 B12R1.43 N[C@H](CC1=CN=CN=C1)C(=O)O Q63781 [1,0,1,0,0,0|2,0,0]=4 29 B12R1.43 N[C@H](CC1=NC=CC=C1)C(=O)O P38457 [1,0,1,0,0,0|1,0,0]=3 30 B12R1.34 CN(C(=O)CCl)C1=CC=CC=C1 P39256 [1,0,1,0,0,0|2,0,0]=4 31 B12R1.34 CN(C(=O)CN)C1=CC=CC=C1 P41882 [1,0,1,0,0,0|1,0,0]=3 32 B12R1.283 NCCC1=CC=CC=C1[N+](=O)[O-] P35716 [1,0,1,0,0,0|0,0,2]=4 33 B12R2.24 NC1CNC2=C(C=CC=C2)C1 O32222 [2,0,0,0,0,0|0,0,1]=3 34 B12R2.24 NC1COC2=C(C=CC=C2)C1 O34395 [2,0,0,0,0,0|1,0,1]=4 35 B12R2.24 N[C@@H]1COC2=C(C=CC=C2)C1 O34281 [2,0,0,0,0,0|1,0,1]=4 36 B12R2.24 N[C@H]1COC2=C(C=CC=C2)C1 O34576 [2,0,0,0,0,0|1,0,1]=4 37 B12R2.24 O=C1CC2=C(C=CC=C2)CN1 P39429 [2,0,0,0,0,0|2,0,0]=4 38 B12R2.24 O=C1CCC2=C(C=CN=C2)N1 I-9788 [2,0,0,0,0,0|1,0,0]=3 39 B12R2.24 O=C1CCC2=CC=CN=C2N1 C-3538 [2,0,0,0,0,0|1,0,0]=3 40 B12R2.24 O=C1CNC2=C(C=CC=C2)N1 O34499 [2,0,0,0,0,0|1,0,0]=3 41 B12R2.24 O=C1COC2=NC=CC=C2N1 Q70041 [2,0,0,0,0,0|2,0,0]=4 42 B12R2.24 O=C1CSC2=C(C=CC=C2)C1 P51461 [2,0,0,0,0,0|2,0,0]=4 43 B12R2.24 O=C1CSC2=NC=CC=C2N1 L19465 [2,0,0,0,0,0|2,0,0]=4 44 B12R2.24 OC1CNC2=C(C=CC=C2)C1 O33538 [2,0,0,0,0,0|1,0,1]=4 45 B12R2.24 O[C@@H]1CNC2=C(C=CC=C2)C1 O33190 [2,0,0,0,0,0|1,0,1]=4 46 B12R2.24 O[C@H]1CNC2=C(C=CC=C2)C1 O33189 [2,0,0,0,0,0|1,0,1]=4 47 B14R1.3135 COC1=CC=CC=C1C[C@@H](N)C(=O)O P40608 [0,1,1,0,0,0|2,0,0]=4 48 B14R1.3135 COC1=CC=CC=C1C[C@H](N)C(=O)O O27906 [0,1,1,0,0,0|2,0,0]=4 49 B14R1.3135 N#CC1=CC=CC=C1CC(N)C(=O)O P39237 [0,1,1,0,0,0|2,0,0]=4 50 B14R1.3135 N#CC1=CC=CC=C1C[C@@H](N)C(=O)O O28703 [0,1,1,0,0,0|2,0,0]=4 51 B14R1.3135 N#CC1=CC=CC=C1C[C@H](N)C(=O)O P39236 [0,1,1,0,0,0|2,0,0]=4 52 B14R1.134 COC(=O)[C@@H](N)CC1=CC=C(Br)C=C1 P34742 [0,1,1,0,0,0|2,0,0]=4 53 B14R1.134 COC(=O)[C@@H](N)CC1=CC=C(Cl)C=C1 P37123 [0,1,1,0,0,0|2,0,0]=4 54 B14R1.134 COC(=O)[C@H](N)CC1=CC=C(Cl)C=C1 P38715 [0,1,1,0,0,0|2,0,0]=4 55 B14R1.135 COC(=O)[C@@H](N)CC1=CC=CC(Cl)=C1 Q65904 [0,1,1,0,0,0|2,0,0]=4 56 B14R1.135 COC(=O)[C@H](N)CC1=CC=CC(Cl)=C1 Q65903 [0,1,1,0,0,0|2,0,0]=4 57 B14R1.425 CN(C)C(=O)[C@H](N)CC1=CC=CC=C1 P40268 [0,1,1,0,0,0|1,0,0]=3 58 B14R1.1007 COC(=O)[C@@H](N)CC1=CC=CC=C1C M22963 [0,1,1,0,0,0|2,0,0]=4 59 B14R1.1007 COC(=O)[C@@H](N)CC1=CC=CC=C1Cl P38006 [0,1,1,0,0,0|2,0,0]=4 60 B14R1.1031 CN[C@@H](CC1=CC=CC=C1)C(=O)OC P40118 [0,1,1,0,0,0|2,0,0]=4 61 B14R1.1031 COC(=O)[C@H](CN)CC1=CC=CC=C1 Q69025 [0,1,1,0,0,0|2,0,0]=4 62 B14R1.243 CC1=CC=CC=C1N(C)C(=O)C(C)N P41587 [0,1,1,0,0,0|1,0,0]=3 63 B14R2.8038 CN1C(=O)NCC2=C(N)C=CC=C21 H-8391 [1,1,0,0,0,0|2,0,0]=4 64 B14R2.28523 CN1C(=O)COC2=CC=CC(N)=C21 O31156 [1,1,0,0,0,0|2,0,0]=4 65 B14R2.29369 CN1C(=O)CCC2=C1C=CC(Br)=C2 P44117 [1,1,0,0,0,0|1,0,0]=3 66 B14R2.8239 CC1OC2=CC=C(Br)C=C2NC1=O O32496 [1,1,0,0,0,0|2,0,0]=4 67 B14R2.28472 CN1CC2=C(C=CC=C2Br)NC1=O H-8171 [1,1,0,0,0,0|2,0,0]=4 68 B14R2.8716 CC1C(=O)N(C)C2=C1C=C(Br)C=C2 Q54215 [0,1,0,0,1,0|2,0,0]=4 69 B14R2.972 COC(=O)C1CC2=C(C=CC=C2)N1 P37208 [0,0,1,1,0,0|2,0,0]=4 70 B14R2.279 NC1C(=O)NCCC2=CC=CC=C21 M15187 [0,0,1,1,0,0|2,0,0]=4 71 B12R2.18 CN1C(=O)CC2=CC=CN=C21 L21471 [1,0,0,0,1,0|2,0,0]=4 72 B12R2.18 CN1C(=O)CC2=CC=NC=C21 Q64411 [1,0,0,0,1,0|2,0,0]=4 73 B14R1.743 COC(=O)CC(N)CC1=CC=CC=C1 P43132 [0,0,1,0,0,1|2,0,0]=4