0 B14R2.8239 NC1=CC2=C(C=C1)NC(=O)C(=O)N2 BBL030834 [0,0,0,0,0,0|2,0,1]=3 1 B14R2.8239 O=C1C=CC2=CC(O)=C(O)C=C2O1 BBL037229 [0,0,0,0,0,0|3,0,1]=4 2 B13R2.155 NC1=CC=C2C=CC(O)=CC2=C1 BBL018005 [1,0,0,0,0,0|2,0,0]=3 3 B13R2.155 O=C1C=CC2=CC=C(O)C=C2O1 BBL027620 [1,0,0,0,0,0|3,0,0]=4 4 B13R2.369 NC1CC2=CC=CC=C2NC1=O BBL008284 [1,0,0,0,0,0|1,0,2]=4 5 B13R2.3683 CC1=CC2=C(C=C1)N=C(C)C=C2 BBL034645 [1,0,0,0,0,0|2,0,1]=4 6 B13R2.3683 CC1=NC2=C(C=C1)C=C(N)C=C2 BBL012761 [1,0,0,0,0,0|2,0,1]=4 7 B13R2.3683 NC1=CC=C2NC(=O)COC2=C1 BBL011145 [1,0,0,0,0,0|2,0,1]=4 8 B13R2.3683 OC1=CC=C2C=C(O)C=CC2=C1 BBL025841 [1,0,0,0,0,0|2,0,1]=4 9 B15R2.63893 CN1C(=O)C(=O)NC2=CC(N)=CC=C21 BBL036685 [0,1,0,0,0,0|2,0,1]=4 10 B15R2.63893 CN1C(=O)C(O)=NC2=CC(N)=CC=C21 BBL022831 [0,1,0,0,0,0|2,0,0]=3 11 B13R1.133 CC(Cl)C(=O)NC1=CC=C(Cl)C=C1 BBL037297 [0,0,1,0,0,0|1,0,2]=4 12 B13R1.133 O=C(O)C(=O)NC1=CC=C(F)C=C1 BBL000519 [0,0,1,0,0,0|1,1,0]=3 13 B13R1.148 O=C(O)C(=O)NC1=CC=CC(Cl)=C1 BBL000510 [0,0,1,0,0,0|2,0,1]=4 14 B13R1.2872 C\C(C=O)=C/C1=CC(Br)=CC=C1O BBL026145 [0,0,1,0,0,0|2,1,0]=4 15 B13R1.2872 C\C(C=O)=C/C1=CC(Cl)=CC=C1O BBL029705 [0,0,1,0,0,0|2,0,0]=3 16 B13R2.3028 O=C1NC2=C(C=C(Cl)C=C2)C1=O BBL027809 [0,0,0,0,1,0|0,0,1]=2 17 B13R2.3028 O=C1NC2=C(C=C(F)C=C2)C1=O BBL011747 [0,0,0,0,1,0|0,1,1]=3 18 B12R1.21 OC(=O)\C=C\C1=CC=C(Cl)C=C1 BBL036957 [1,0,1,0,0,0|2,0,0]=4 19 B12R1.43 O=C(O)C(=O)NC1=CC=CC=C1 BBL005466 [1,0,1,0,0,0|1,0,0]=3 20 B12R1.226 O=C(O)\C=C\C1=CC(Cl)=CC=C1 BBL034639 [1,0,1,0,0,0|1,0,0]=3 21 B12R1.226 O=C(O)\C=C\C1=CC(O)=CC=C1 BBL013143 [1,0,1,0,0,0|2,0,0]=4 22 B12R2.24 ClC1=CC2=C(C=C1)N=CC=C2 BBL011738 [2,0,0,0,0,0|0,0,1]=3 23 B12R2.24 SC1=CC=C2C=CC=CC2=C1 BBL013183 [2,0,0,0,0,0|1,1,0]=4 24 B14R1.6049 CC1=CC(C)=C(NC(=O)C(=O)O)C=C1 BBL000487 [0,1,1,0,0,0|2,0,0]=4 25 B14R2.1128 O=CC1=CC2=CC=CC=C2NC1=O BBL028761 [1,1,0,0,0,0|0,0,1]=3 26 B14R2.8188 NN1C(=O)NC2=CC=CC=C2C1=O BBL012016 [1,1,0,0,0,0|2,0,0]=4 27 B14R2.8235 CC1=NC2=CC=C(Cl)C=C2C(N)=C1 BBL031480 [1,1,0,0,0,0|1,0,1]=4 28 B14R2.8235 O=C1NC2=C(C=C(Br)C=C2)C(=O)O1 BBL011748 [1,1,0,0,0,0|1,1,0]=4 29 B14R2.8235 O=C1NC2=CC=C(Cl)C=C2C(=O)O1 BBL009787 [1,1,0,0,0,0|1,0,0]=3 30 B14R2.8716 CN1C(=O)C(=O)C2=C1C=CC(Br)=C2 BBL011717 [0,1,0,0,1,0|0,1,1]=4 31 B14R2.8716 CN1C(=O)C(N)C2=CC(Cl)=CC=C21 BBL031698 [0,1,0,0,1,0|1,0,1]=4 32 B14R2.9184 CC1=CC(Br)=CC2=C1NC(=O)C2=O BBL028656 [0,1,0,0,1,0|0,1,1]=4 33 B14R2.9184 CC1=CC(C)=C2NC(=O)C(=O)C2=C1 BBL012192 [0,1,0,0,1,0|1,0,1]=4 34 B14R2.9184 O=C1NC2=C(Br)C=C(Cl)C=C2C1=O BBL029227 [0,1,0,0,1,0|0,0,1]=3 35 B14R2.9184 O=C1NC2=C(Cl)C=C(Br)C=C2C1=O BBL030025 [0,1,0,0,1,0|0,1,1]=4 36 B14R2.9184 O=C1NC2=C(Cl)C=C(Cl)C=C2C1=O BBL013172 [0,1,0,0,1,0|0,0,1]=3 37 B14R2.27750 O=C1NC2=C(C1=O)C(Cl)=CC(Cl)=C2 BBL029536 [0,1,0,0,1,0|1,0,1]=4 38 B16R2.5907 CC1=C(C)C2=CC(Cl)=C(O)C=C2OC1=O BBL031158 [0,2,0,0,0,0|2,0,0]=4 39 B16R2.23521 O=C(Cl)C1=CC2=C(C=CC(Cl)=C2)OC1=O BBL014498 [0,2,0,0,0,0|1,0,1]=4 40 B16R2.23521 O=C(O)C1=CC2=CC(Br)=CC=C2OC1=O BBL013807 [0,2,0,0,0,0|1,1,0]=4 41 B16R2.23521 O=C(O)C1=CC2=CC(Cl)=CC=C2OC1=O BBL014105 [0,2,0,0,0,0|1,0,0]=3 42 B16R2.192589 CC1=CC(C)=C2NC(=O)C(C=O)=CC2=C1 BBL029548 [0,2,0,0,0,0|1,0,1]=4 43 B14R2.4529 O=C(O)C1=CC2=CC(Cl)=CC=C2N1 BBL001474 [0,0,1,1,0,0|2,0,0]=4 44 B14R2.7969 O=C(O)C1=CC2=CC=CC(Cl)=C2N1 BBL022253 [0,0,1,1,0,0|2,0,0]=4 45 B14R2.7969 O=C(O)C1=CC2=CC=CC(Cl)=C2S1 BBL030767 [0,0,1,1,0,0|1,1,0]=4 46 B12R2.606 SC1=NC2=C(C=CC(Cl)=C2)N1 BBL003399 [1,0,0,0,1,0|1,1,0]=4 47 B12R2.18 NC1C(=O)NC2=CC=CC=C21 BBL010068 [1,0,0,0,1,0|1,0,1]=4