0 B13R2.162 NC1CCCC2=CC=C(Br)C=C21 YH90668 [1,0,0,0,0,0|3,0,0]=4 1 B13R2.162 OC1=CC2=C(C=C1)CNCC2O RT7840 [1,0,0,0,0,0|3,0,0]=4 2 B13R2.3683 CC1CC2=CC=C(Br)C=C2CN1 YH89207 [1,0,0,0,0,0|3,0,0]=4 3 B13R2.3683 O=C1CCC2=C(C=CC(Cl)=C2)N1 YH43343 [1,0,0,0,0,0|2,0,1]=4 4 B13R2.3683 O=C1CCC2=CC(Br)=CC=C2N1 YH54618 [1,0,0,0,0,0|2,0,1]=4 5 B13R2.3683 O=C1CCC2=CC(O)=CC=C2N1 LT1317 [1,0,0,0,0,0|2,0,1]=4 6 B13R1.446 CNCC(O)C1=CC(O)=CC=C1Br RT3619 [0,0,1,0,0,0|3,0,0]=4 7 B13R1.446 CNC[C@H](O)C1=CC(O)=CC=C1Br RT1881 [0,0,1,0,0,0|3,0,0]=4 8 B12R1.32 CN(CCO)CC1=CC=CC=C1 RT11841 [1,0,1,0,0,0|2,0,0]=4 9 B12R1.17 CNCC(O)C1=CC=CC(O)=C1 RT0358 [1,0,1,0,0,0|2,0,0]=4 10 B12R1.17 CNC[C@H](O)C1=CC=CC(O)=C1 XJ0007 [1,0,1,0,0,0|2,0,0]=4 11 B12R2.24 CC1=CC2=C(C=C1)NCCC2 XJ0199 [2,0,0,0,0,0|0,0,0]=2 12 B12R2.24 CC1CCC2=CC=CC=C2N1 XJ1928 [2,0,0,0,0,0|0,0,0]=2 13 B12R2.24 C[C@@H]1CNC2=C(C=CC=C2)N1 LT1109 [2,0,0,0,0,0|1,0,0]=3 14 B12R2.24 C[C@H]1CNC2=C(C=CC=C2)N1 LT1108 [2,0,0,0,0,0|1,0,0]=3 15 B12R2.24 FC1=CC2=C(C=C1)OCCC2 RT8167 [2,0,0,0,0,0|2,0,0]=4 16 B12R2.24 NC1CCC2=C(C=CC=C2)C1 YH65482 [2,0,0,0,0,0|2,0,0]=4 17 B12R2.24 NC1CCC2=CC=CC=C2C1 JZ2198 [2,0,0,0,0,0|2,0,0]=4 18 B12R2.24 N[C@@H]1CCC2=CC=CC=C2C1 JZ5475 [2,0,0,0,0,0|2,0,0]=4 19 B12R2.24 N[C@H]1CCC2=C(C=CC=C2)C1 LQ4317 [2,0,0,0,0,0|2,0,0]=4 20 B12R2.24 OC1=CC2=C(C=C1)CCCC2 LT3595 [2,0,0,0,0,0|2,0,0]=4 21 B12R2.24 OC1=CC2=C(C=C1)OCCC2 CJ2929 [2,0,0,0,0,0|2,0,0]=4 22 B12R2.24 OC1=CC=C2NCCCC2=C1 LT6061 [2,0,0,0,0,0|1,0,0]=3 23 B12R2.1081 CC1CCNC2=C1C=CC=C2 JZ5356 [2,0,0,0,0,0|1,0,0]=3 24 B12R2.1081 NC1CCNC2=CC=CC=C21 YH65897 [2,0,0,0,0,0|1,0,0]=3 25 B12R2.1081 N[C@@H]1CCCC2=CC=CC=C21 JZ5559 [2,0,0,0,0,0|2,0,0]=4 26 B12R2.1081 N[C@H]1CCCC2=C1C=CC=C2 XJ5138 [2,0,0,0,0,0|2,0,0]=4 27 B12R2.1081 N[C@H]1CCCC2=CC=CC=C21 JZ5560 [2,0,0,0,0,0|2,0,0]=4 28 B12R2.1081 OC1CCCC2=C1C=CC=N2 YH65731 [2,0,0,0,0,0|2,0,0]=4 29 B12R2.1081 OC1CCCC2=CC=CN=C21 YH35264 [2,0,0,0,0,0|2,0,0]=4 30 B12R2.1081 OC1CCNC2=C1C=CC=C2 YH48820 [2,0,0,0,0,0|0,0,0]=2 31 B12R2.1081 OC1CNCC2=C1C=CC=C2 RT7798 [2,0,0,0,0,0|2,0,0]=4 32 B14R2.2332 OCC1CCC2=CC(F)=CC=C2O1 RT8746 [1,1,0,0,0,0|2,0,0]=4 33 B14R2.25731 CN1CC(O)C2=CC(=O)C(=O)C=C21 LT7693 [0,1,0,0,1,0|2,0,0]=4 34 B14R2.25731 CN1CC(O)C2=CC(=O)C(=O)C=C21 RT8640 [0,1,0,0,1,0|2,0,0]=4 35 B12R1.16 CCCC(C)C1=CC=C(O)C=C1 RT17651 [0,0,1,0,1,0|2,0,0]=4 36 B12R1.16 N[C@@H](CCO)C1=CC=C(Cl)C=C1 LX2785 [0,0,1,0,1,0|2,0,0]=4 37 B12R1.16 N[C@H](CCO)C1=CC=C(F)C=C1 YH47867 [0,0,1,0,1,0|2,0,0]=4 38 B12R2.132 CC1=CC=C2CCC(=O)C2=C1 LQ4410 [1,0,0,0,1,0|0,0,2]=4 39 B12R2.132 NC1CCC2=CC=C(Br)C=C21 YH94710 [1,0,0,0,1,0|2,0,0]=4 40 B12R2.132 N[C@@H]1CCC2=C1C=C(O)C=C2 RT1823 [1,0,0,0,1,0|2,0,0]=4 41 B12R2.132 N[C@@H]1CCC2=CC=C(F)C=C21 YH19003 [1,0,0,0,1,0|2,0,0]=4 42 B12R2.18 OC1C2=C(C=CC=C2)CC1Br HL2931 [1,0,0,0,1,0|2,0,0]=4 43 B12R2.606 CC1=CC2=C(C=C1)NC(C)=C2 JZ4489 [1,0,0,0,1,0|0,0,2]=4 44 B12R2.612 CC1=CC2=C(C=N1)C(N)CC2 YH66299 [1,0,0,0,1,0|2,0,0]=4 45 B12R2.612 CC1=CC=C2C(=O)CCC2=C1 HL2805 [1,0,0,0,1,0|1,0,1]=4 46 B12R2.612 CC1=COC2=C1CCC(C)C2 LL0892 [1,0,0,0,1,0|2,0,0]=4 47 B12R2.612 NC1CCC2=CC(Br)=CC=C21 YH97266 [1,0,0,0,1,0|2,0,0]=4