0 B14R2.20 CC1=CC=C(C2=CSC(N)=N2)C=C1 LQ2044 [0,0,0,0,0,0|1,1,2]=4 1 B14R2.20 NC1=NN=C(C2=CC=C(Cl)C=C2)O1 CJ3245 [0,0,0,0,0,0|3,0,1]=4 2 B14R2.20 NC1=NN=C(C2=CC=C(Cl)C=C2)S1 CJ3241 [0,0,0,0,0,0|3,0,1]=4 3 B14R2.20 N[C@@H]1CC[C@H](C2=CC=C(Br)C=C2)C1 RT11866 [0,0,0,0,0,0|2,1,1]=4 4 B14R2.20 N[C@H]1CC[C@@H](C2=CC=C(Br)C=C2)C1 RT17445 [0,0,0,0,0,0|2,1,1]=4 5 B14R2.20 O=C1CC(C2=CC=C(Cl)C=C2)CN1 YH47580 [0,0,0,0,0,0|3,0,0]=3 6 B14R2.20 O=C1CC(C2=CC=C(F)C=C2)CN1 LX2161 [0,0,0,0,0,0|3,1,0]=4 7 B14R2.20 O=C1N[C@H](C2=CC=C(Cl)C=C2)CO1 YH66636 [0,0,0,0,0,0|1,0,1]=2 8 B13R2.10 CC1=NC(C2=CC=CC=C2)=NO1 JZ4499 [1,0,0,0,0,0|2,0,1]=4 9 B13R2.10 NC1=NC(C2=CC=CC=C2)=CS1 XJ1987 [1,0,0,0,0,0|0,1,2]=4 10 B13R2.10 NC1=N[C@H](C2=CC=CC=C2)CO1 RT4321 [1,0,0,0,0,0|0,0,0]=1 11 B13R2.10 O=C1CC(C2=CC=CC=C2)CN1 YH27765 [1,0,0,0,0,0|3,0,0]=4 12 B13R2.10 O=C1CCC(C2=CC=CC=C2)O1 HL0603 [1,0,0,0,0,0|3,0,0]=4 13 B13R2.10 O=C1NCC(C2=CC=CC=C2)N1 RT9150 [1,0,0,0,0,0|2,0,1]=4 14 B13R2.10 O=C1N[C@@H](C2=CC=CC=C2)CO1 SY0295 [1,0,0,0,0,0|1,0,1]=3 15 B13R2.10 O=C1N[C@H](C2=CC=CC=C2)CO1 RT7870 [1,0,0,0,0,0|1,0,1]=3 16 B13R2.10 S=C1N[C@@H](C2=CC=CC=C2)CS1 YH42187 [1,0,0,0,0,0|1,1,1]=4 17 B13R2.12 ClC1=CC=C(C2CCCN2)C=C1 LT1081 [1,0,0,0,0,0|1,0,2]=4 18 B15R2.309 C[C@H]1NC(=O)S[C@@H]1C2=CC=C(Cl)C=C2 LT5187 [0,1,0,0,0,0|3,0,0]=4 19 B13R1.14 COC(=O)CCC1=CC=C(O)C=C1 JZ2791 [0,0,1,0,0,0|3,0,0]=4 20 B13R1.14 COC(=O)COC1=CC=C(Cl)C=C1 YH03119 [0,0,1,0,0,0|3,0,0]=4 21 B13R1.14 COC(=O)\C=C\C1=CC=C(Cl)C=C1 YH66453 [0,0,1,0,0,0|2,0,1]=4 22 B13R1.132 NC(CC(=O)O)C1=CC=C(Cl)C=C1 YH44118 [0,0,1,0,0,0|3,0,0]=4 23 B13R1.132 N[C@@H](CC(=O)O)C1=CC=C(Cl)C=C1 HL3434 [0,0,1,0,0,0|3,0,0]=4 24 B13R1.132 N[C@H](CC(=O)O)C1=CC=C(Cl)C=C1 HL3435 [0,0,1,0,0,0|3,0,0]=4 25 B13R1.513 CC(=O)OCCC1=CC=C(O)C=C1 RT6322 [0,0,1,0,0,0|3,0,0]=4 26 B13R1.513 O=C(O)CCCC1=CC=C(Cl)C=C1 YH02376 [0,0,1,0,0,0|3,0,0]=4 27 B13R2.147 O=C1CC(C2=CC=C(Br)C=C2)C1 YH49800 [0,0,0,0,1,0|2,1,0]=4 28 B15R2.98 NC1=CC=C(CC2COC(=O)N2)C=C1 LT6237 [0,0,0,0,0,1|2,0,1]=4 29 B12R1.21 N=C(N)SCC1=CC=C(Cl)C=C1 HL1964 [1,0,1,0,0,0|2,0,0]=4 30 B12R1.27 COC(=O)OCC1=CC=CC=C1 RT11038 [1,0,1,0,0,0|2,0,0]=4 31 B12R1.107 CC(CC(=O)O)C1=CC=CC=C1 LT6844 [1,0,1,0,0,0|2,0,0]=4 32 B12R1.252 CC(=O)OCCC1=CC=CC=C1 LL0321 [1,0,1,0,0,0|2,0,0]=4 33 B12R1.252 NC(=S)NCCC1=CC=CC=C1 LQ3182 [1,0,1,0,0,0|2,0,0]=4 34 B12R2.2 C1=CC=C(C2=COC=N2)C=C1 YH45253 [2,0,0,0,0,0|0,0,2]=4 35 B12R2.2 C1=CN=CC(C2CCC=N2)=C1 RT14595 [2,0,0,0,0,0|2,0,0]=4 36 B14R1.10 COC(=O)C[C@H](N)C1=CC=C(Cl)C=C1 YH65673 [0,1,1,0,0,0|2,0,0]=4 37 B12R1.49 COC(=O)CC1=CC=C(Br)C=C1 XJ5486 [0,0,1,0,1,0|1,1,0]=4 38 B12R1.49 COC(=O)CC1=CC=C(Cl)C=C1 YH05226 [0,0,1,0,1,0|1,0,0]=3 39 B12R1.49 COC(=O)CC1=CC=C(O)C=C1 JZ4903 [0,0,1,0,1,0|2,0,0]=4 40 B12R1.20 CC(C(=O)O)C1=CC=C(Cl)C=C1 JZ4316 [0,0,1,0,1,0|1,0,0]=3 41 B12R1.20 CC(C(=O)O)C1=CC=C(O)C=C1 JZ4317 [0,0,1,0,1,0|2,0,0]=4 42 B12R1.20 N[C@H](C(=O)O)C1=CC=C(Cl)C=C1 YH13184 [0,0,1,0,1,0|2,0,0]=4 43 B12R1.20 O=C(O)C(O)C1=CC=C(Cl)C=C1 LL0881 [0,0,1,0,1,0|2,0,0]=4 44 B12R1.20 O=C(O)[C@H](O)C1=CC=C(Cl)C=C1 YH54312 [0,0,1,0,1,0|2,0,0]=4 45 B12R2.22 O=C1CC(C2=CC=CC=C2)C1 YH05386 [1,0,0,0,1,0|2,0,0]=4 46 B12R2.2302 ClC1=CC=C(C2CNC2)C=C1 RT9918 [1,0,0,0,1,0|1,0,1]=4 47 B12R2.79 NC1CC1C2=CC=C(F)C=C2 RT3576 [0,0,0,0,2,0|0,1,1]=4 48 B12R2.79 N[C@@H]1C[C@H]1C2=CC=C(F)C=C2 RT3436 [0,0,0,0,2,0|0,1,1]=4 49 B14R2.19 O=C1N[C@@H](CC2=CC=CC=C2)CO1 RT6827 [1,0,0,0,0,1|1,0,1]=4 50 B14R2.19 O=C1N[C@H](CC2=CC=CC=C2)CO1 RT6803 [1,0,0,0,0,1|1,0,1]=4