0 B12R1.30 NCCNC(=O)C1=CC=CC=C1 4648-5-74 [0,0,0,0,0,0|2,0,0]=2 1 B12R1.30 O=CNCC(=O)C1=CC=CC=C1 4648-1-2U [0,0,0,0,0,0|3,0,1]=4 2 B11R1.16 CC(CCN)C1=CC=CC=C1 3630-1-26 [1,0,0,0,0,0|2,0,1]=4 3 B11R1.16 CCCC(N)C1=CC=NC=C1 3H30-1-VE [1,0,0,0,0,0|2,0,1]=4 4 B11R1.28 N#CCOCC1=CC=CC=C1 4637-1-1L [1,0,0,0,0,0|1,0,2]=4 5 B13R1.17 CCCNC(=O)C1=CC=C(Cl)C=C1 4648-5-2P [0,1,0,0,0,0|1,0,0]=2 6 B13R1.17 O=C(CCCBr)C1=CC=C(Cl)C=C1 2617-D-13 [0,1,0,0,0,0|2,0,0]=3 7 B13R1.17 O=C(CCCBr)C1=CC=C(F)C=C1 2617-B-76 [0,1,0,0,0,0|2,0,0]=3 8 B13R1.17 O=C(NCCO)C1=CC=C(Cl)C=C1 4648-5-2Q [0,1,0,0,0,0|2,0,0]=3 9 B13R1.18 CCCNC(=O)C1=CC(Cl)=CC=C1 4648-5-2V [0,1,0,0,0,0|1,0,0]=2 10 B13R1.18 CCCNC(=O)C1=CC(O)=CC=C1 4648-1-5Q [0,1,0,0,0,0|1,0,0]=2 11 B13R1.18 CCCOC(=O)C1=CC(O)=CC=C1 2623-1-2Z [0,1,0,0,0,0|0,0,0]=1 12 B13R1.18 CCCOC(=O)C1=CC=CC(Cl)=C1 2623-5-1B [0,1,0,0,0,0|0,0,0]=1 13 B13R1.18 O=C(NCCCl)C1=CC=CC(O)=C1 4648-5-2J [0,1,0,0,0,0|2,0,0]=3 14 B13R2.2931 COC1OC(=O)C2=CC=CC=C21 2H25-1-2R [0,0,0,1,0,0|1,0,0]=2 15 B13R2.8137 N[C@H](C1=CC=CC=C1)C2CCC2 3630-5-S0 [0,0,0,1,0,0|2,0,1]=4 16 B13R1.44 O=C(CC1=CC=CC=C1)NCCCl 4648-5-0M [0,0,0,0,0,1|2,0,0]=3 17 B10R1.15 C=C(CBr)C1=CC=CC=C1 1900-9-0J [2,0,0,0,0,0|2,0,0]=4 18 B10R1.15 C=CC(=O)C1=CC=CC=C1 2617-1-0U [2,0,0,0,0,0|0,0,2]=4 19 B10R1.15 CC[C@@H](O)C1=CC=CC=C1 2602-1-R4 [2,0,0,0,0,0|0,0,2]=4 20 B10R1.15 O=C(CCl)C1=CC=NC=C1 4H33-5-0L [2,0,0,0,0,0|2,0,0]=4 21 B10R1.17 CCCCC1=CC=NC=C1 3H32-1-JJ [2,0,0,0,0,0|1,0,1]=4 22 B10R1.17 CCOCC1=CC=CC=C1 2607-1-1V [2,0,0,0,0,0|0,0,1]=3 23 B10R1.17 NCCOC1=CC=NC=C1 4H56-5-NK [2,0,0,0,0,0|2,0,0]=4 24 B12R1.16 CCNC(=O)C1=CC=C(Cl)C=C1 4648-5-2M [1,1,0,0,0,0|1,0,0]=3 25 B12R1.16 CCNC(=O)C1=CC=C(O)C=C1 4648-1-3X [1,1,0,0,0,0|1,0,0]=3 26 B12R1.16 CCOC(=O)C1=CN=C(O)N=C1 4H23-1-FA [1,1,0,0,0,0|2,0,0]=4 27 B12R1.16 CONC(=O)C1=CC=C(Cl)C=C1 4648-5-2L [1,1,0,0,0,0|2,0,0]=4 28 B12R1.16 CONC(=O)C1=CC=C(O)C=C1 4648-1-5H [1,1,0,0,0,0|2,0,0]=4 29 B12R1.17 CCNC(=O)C1=CC(Cl)=CC=C1 4648-5-2Z [1,1,0,0,0,0|1,0,0]=3 30 B12R1.17 CCOC(=O)C1=CC(=O)N=CN1 4H58-1-XW [1,1,0,0,0,0|2,0,0]=4 31 B12R1.107 C\C(N)=C\C(=O)C1=CC=CC=C1 4636-1-Z8 [1,1,0,0,0,0|0,0,2]=4 32 B12R1.308 C=COC(=O)C1=C(Cl)C=CC=C1 2624-5-02 [1,1,0,0,0,0|0,0,2]=4 33 B12R1.308 CCNC(=O)C1=C(O)C=CC=C1 4648-1-3Y [1,1,0,0,0,0|1,0,0]=3 34 B12R1.1 CCCCOC1=CC=C(Cl)C=C1 2607-5-2L [1,1,0,0,0,0|2,0,0]=4 35 B12R1.1 CCCCSC1=CC=C(O)C=C1 6666-1-1C [1,1,0,0,0,0|2,0,0]=4 36 B12R1.1 ClCCOCC1=CC=C(Cl)C=C1 2607-5-0Z [1,1,0,0,0,0|1,0,1]=4 37 B12R1.27 C[C@@H](CO)OCC1=CC=CC=C1 2607-1-S1 [1,1,0,0,0,0|1,0,1]=4 38 B12R1.28 CCCCOC1=CC(Cl)=CC=C1 2607-5-2M [1,1,0,0,0,0|2,0,0]=4 39 B12R1.28 CCCCSC1=CC(O)=CC=C1 6666-1-1M [1,1,0,0,0,0|2,0,0]=4 40 B12R1.28 OCCOCC1=CC=CC(Cl)=C1 2607-5-0X [1,1,0,0,0,0|1,0,1]=4 41 B12R1.35 O=C(OCCCF)N1C=CN=C1 4H56-3-4K [0,1,0,0,1,0|2,0,0]=4 42 B14R1.34 CCCNC(=O)CC1=CC(O)=CC=C1 4648-1-6J [0,1,0,0,0,1|1,0,0]=3 43 B14R1.19 N#CCCNC(=O)C1=CC=C(O)C=C1 4648-1-4W [0,2,0,0,0,0|1,0,1]=4 44 B14R1.35 O=C(C1=CC=C(Cl)C=C1)C(Br)CCCl 2617-D-03 [0,2,0,0,0,0|2,0,0]=4 45 B14R1.678 CC(=O)CCC(=O)C1=CC=C(Cl)C=C1 2617-5-0M [0,2,0,0,0,0|1,0,1]=4 46 B14R1.941 C=CCOC(=O)C1=CC=C(N)C(F)=C1 4H30-3-0T [0,2,0,0,0,0|0,0,2]=4 47 B14R1.149 CC(C)CNC(=O)C1=CC(O)=CC=C1 4648-1-5U [0,2,0,0,0,0|1,0,0]=3 48 B14R1.163 COC(=O)CNC(=O)C1=CC=CC=C1 4658-1-3W [0,2,0,0,0,0|1,0,1]=4 49 B14R1.3348 CCOC(=O)C(=O)C1=CC=CC=C1Cl 2629-5-43 [0,2,0,0,0,0|2,0,0]=4 50 B12R2.2 C1=CC=C(C2CCCO2)C=C1 2H10-1-82 [1,0,0,1,0,0|0,0,2]=4 51 B12R2.2 C1=CC=C([C@H]2CCCN2)C=C1 3H31-5-RF [1,0,0,1,0,0|1,0,1]=4 52 B12R2.1081 CC1=NCCC2=C1C=CC=C2 3H32-1-NK [1,0,0,1,0,0|2,0,0]=4 53 B12R2.1081 O=C1CCCC2=CC=NC=C12 4H17-5-3C [1,0,0,1,0,0|1,0,0]=3 54 B12R2.1081 O=C1CCCC2=CN=CC=C12 4H56-5-BC [1,0,0,1,0,0|1,0,0]=3 55 B12R2.2075 N[C@H](C1=CC=CC=C1)C2CC2 3633-5-S1 [1,0,0,1,0,0|1,0,1]=4 56 B14R2.933 O=C(NC1CC1)C2=CC=C(Cl)C=C2 4648-5-2N [0,1,0,1,0,0|1,0,0]=3 57 B14R2.933 O=C(NC1CC1)C2=CC=C(O)C=C2 4648-1-4B [0,1,0,1,0,0|1,0,0]=3 58 B14R2.685 NC1=CC=CC2=C1NCCNC2=O 4H54-1-99 [0,1,0,1,0,0|2,0,0]=4 59 B14R2.9036 O=C(NC1CC1)C2=CC=CC(Cl)=C2 4648-5-3A [0,1,0,1,0,0|1,0,0]=3 60 B14R2.29285 CC1(C)CCC(=O)C2=CC=CC=C21 2617-1-1A [0,1,0,1,0,0|1,0,0]=3 61 B14R2.44 NCCN1CC2=CC=CC=C2C1=O 4H48-1-NY [0,1,0,1,0,0|2,0,0]=4 62 B14R1.156 N#CCOC(=O)\C=C/C1=CC=CC=C1 4637-1-ZD [0,0,0,0,0,2|1,0,1]=4