0 B14R1.423 O=C(O)CNC(=O)CC1=CC=CC=C1 4648-1-2S [0,0,0,0,0,0|3,0,1]=4 1 B13R1.44 C=CCOC(=O)OC1=CC=CC=C1 2628-1-00 [1,0,0,0,0,0|1,0,2]=4 2 B13R1.44 O=C(CC1=CC=CC=C1)NCCO 4648-1-1A [1,0,0,0,0,0|2,0,0]=3 3 B13R1.337 CC(C)CCOCC1=CC=CC=C1 2607-1-1U [1,0,0,0,0,0|2,0,0]=3 4 B13R1.45 C=C(CCN(C)C)C1=CC=CC=C1 3932-1-01 [0,0,0,0,1,0|3,0,0]=4 5 B13R1.45 CC(=O)COC(=O)C1=CC=CC=C1 2623-1-4Q [0,0,0,0,1,0|1,0,1]=3 6 B13R1.45 CC(C)=NOC(=O)C1=CC=CC=C1 4647-1-0H [0,0,0,0,1,0|1,0,1]=3 7 B13R1.45 CC(C)COC(=O)C1=CC=CC=C1 2623-1-3V [0,0,0,0,1,0|0,0,0]=1 8 B13R1.45 CC(C)NNC(=O)C1=CC=NC=C1 4H56-1-07L [0,0,0,0,1,0|3,0,0]=4 9 B13R1.45 CC(F)COC(=O)C1=CC=CC=C1 2623-3-1H [0,0,0,0,1,0|1,0,0]=2 10 B13R1.45 CC(O)CNC(=O)C1=CC=CC=C1 4656-1-9K [0,0,0,0,1,0|2,0,0]=3 11 B13R1.45 CN(C)CCC(=O)C1=CC=CC=C1 4630-5-0G [0,0,0,0,1,0|2,0,0]=3 12 B13R1.45 CN(C)C\C=C(/Br)C1=CC=CC=C1 3932-9-01 [0,0,0,0,1,0|3,0,0]=4 13 B13R1.45 CN(C)\C=N\C(=O)C1=CC=CC=C1 4648-1-88 [0,0,0,0,1,0|2,0,1]=4 14 B13R1.45 O=C(OCC(F)F)C1=CC=CC=C1 2623-3-1M [0,0,0,0,1,0|2,0,0]=3 15 B13R1.348 CC(=O)CC(=O)NC1=CC=CC=C1 4H48-1-035 [0,0,0,0,1,0|2,0,1]=4 16 B13R1.348 CC(C)CC(O)CC1=CC=CC=C1 2602-1-06 [0,0,0,0,1,0|0,0,2]=3 17 B13R1.348 CC(C)NC(=O)OC1=CC=CC=C1 4656-1-G3 [0,0,0,0,1,0|2,0,0]=3 18 B12R1.8 CCCCNCC1=CC=CC=C1 3731-1-X5 [2,0,0,0,0,0|2,0,0]=4 19 B12R1.32 CCCC(=O)CC1=CC=CC=C1 2617-1-0X [2,0,0,0,0,0|0,0,0]=2 20 B12R1.32 CCCC(=O)OC1=CC=CC=C1 2623-1-16 [2,0,0,0,0,0|1,0,0]=3 21 B12R1.32 CCOC(=O)CC1=CC=CC=N1 4H23-1-4K [2,0,0,0,0,0|1,0,0]=3 22 B12R1.32 CCOC(=O)CC1=CC=CN=C1 4H23-1-M0 [2,0,0,0,0,0|1,0,0]=3 23 B12R1.32 CCOC(=O)CC1=CC=NC=C1 4H23-1-G6 [2,0,0,0,0,0|1,0,0]=3 24 B12R1.32 CCOC(=O)CC1=NC=CC=N1 4H58-1-UA [2,0,0,0,0,0|2,0,0]=4 25 B12R1.32 CCOC(=O)CC1=NC=CN=C1 4H23-1-KR [2,0,0,0,0,0|2,0,0]=4 26 B12R1.32 O=C(CCCl)NC1=CC=CC=C1 4648-5-2W [2,0,0,0,0,0|2,0,0]=4 27 B12R1.32 O=C(CCCl)OC1=CC=CC=C1 2623-5-1M [2,0,0,0,0,0|2,0,0]=4 28 B14R1.149 CC(C)CNC(=O)C1=CC=CC(Br)=C1 4648-9-24 [0,1,0,0,1,0|1,0,0]=3 29 B14R1.678 CC(C)COC(=O)C1=CC=C(O)C=C1 2623-1-1N [0,1,0,0,1,0|0,0,0]=2 30 B14R1.678 CC1=CC=C(C(=O)CCN(C)C)C=C1 4630-5-0H [0,1,0,0,1,0|2,0,0]=4 31 B14R1.3098 CC(F)(F)COC(=O)C1=CC=CC=C1 2623-3-1P [0,1,0,0,1,0|1,0,0]=3 32 B14R1.3098 O=C(OCC(Cl)(Cl)Cl)C1=CC=CC=C1 2623-5-0J [0,1,0,0,1,0|2,0,0]=4 33 B14R1.3098 O=C(OCC(F)(F)F)C1=CC=CC=C1 2623-3-1N [0,1,0,0,1,0|2,0,0]=4 34 B14R1.433 CC(C)(C)OC(=O)CC1=CC=NC=C1 4H23-1-HX [0,1,0,0,1,0|1,0,0]=3 35 B14R1.433 CC(C)(C)OC(=O)CC1=NC=CC=C1 4H23-1-HY [0,1,0,0,1,0|1,0,0]=3 36 B14R1.433 CC(C)(C)OC(=O)NC1=CC=CC=C1 4656-1-9R [0,1,0,0,1,0|1,0,0]=3 37 B14R1.433 CC(C)(C)OC(=O)NC1=CC=CC=N1 4H51-1-2L [0,1,0,0,1,0|2,0,0]=4 38 B14R1.433 CC(C)(C)OC(=O)NC1=CC=CN=C1 4H56-1-09E [0,1,0,0,1,0|2,0,0]=4 39 B14R1.433 CC(C)(C)OC(=O)NC1=CC=NC=C1 4H56-1-8Y [0,1,0,0,1,0|2,0,0]=4 40 B14R1.698 CC1=CC=C(OC(=O)CC(C)C)C=C1 2723-1-1R [0,1,0,0,1,0|1,0,0]=3 41 B16R1.22556 CC(C)(C)NCC(=O)COC1=CC=CC=C1 4656-5-0G [0,1,0,0,0,1|2,0,0]=4 42 B16R1.22556 CC(C)(C)NCC(=O)OCC1=CC=CC=C1 4658-1-51 [0,1,0,0,0,1|2,0,0]=4 43 B14R2.24 O=C1CCCCC1C2=CC=CC=C2 2617-1-1P [1,0,0,1,0,0|1,0,0]=3 44 B14R2.24 O=C1CCCCC1C2=CC=CC=N2 4H17-1-2D [1,0,0,1,0,0|2,0,0]=4 45 B14R2.24 O=C1CCNCC1C2=CC=CC=C2 4H56-5-BD [1,0,0,1,0,0|2,0,0]=4 46 B14R2.24 O=C1NCCCN1C2=CC=CC=C2 4H48-1-5R [1,0,0,1,0,0|2,0,0]=4 47 B14R2.24 O=C1NCCNC1C2=CC=CC=C2 4H48-1-06P [1,0,0,1,0,0|2,0,0]=4 48 B14R2.24 O=C1NCCSC1C2=CC=CC=C2 8H17-1-06 [1,0,0,1,0,0|2,0,0]=4 49 B14R2.517 CCCN1C(=O)NC2=CC=CC=C21 4H53-1-1N [1,0,0,1,0,0|2,0,0]=4 50 B14R2.9589 O=C(NC1=CC=CC=C1)C2CCC2 4618-1-01 [1,0,0,1,0,0|2,0,0]=4 51 B14R2.598 O=C1CC(C2=CC=CC=C2)C(=O)O1 2H26-1-0E [0,0,0,1,1,0|1,0,1]=4 52 B14R2.642 CC(C)N1C(=O)NC2=CC=CC=C21 4H53-1-1M [0,0,0,1,1,0|2,0,0]=4 53 B14R2.8189 CC1(C)CC(=O)NC2=CC=CC=C21 4H48-1-08V [0,0,0,1,1,0|1,0,0]=3 54 B16R2.3322 NC1CN(C(=O)OCC2=CC=CC=C2)C1 4H56-1-MM [0,0,0,1,0,1|2,0,0]=4 55 B16R2.3322 O=C(OCC1=CC=CC=C1)N2CC(Br)C2 4H48-9-94 [0,0,0,1,0,1|2,0,0]=4 56 B16R2.3322 O=C(OCC1=CC=CC=C1)N2CC(I)C2 4H51-H-06 [0,0,0,1,0,1|2,0,0]=4 57 B16R2.12060 CC1(C)CNC(=O)N1CC2=CC=CC=C2 4H48-1-UB [0,0,0,1,0,1|1,0,0]=3 58 B12R1.30 C#CCOC(=O)C1=CC=CC=C1 2623-1-17 [1,0,0,0,1,0|0,0,2]=4 59 B12R1.30 C=CCOC(=O)C1=CC=CC=C1 2623-1-2L [1,0,0,0,1,0|0,0,2]=4 60 B12R1.30 CCCCC(=O)C1=NC=CC=C1 4H17-1-9Z [1,0,0,0,1,0|2,0,0]=4 61 B12R1.30 CCSCC(=O)C1=CC=CC=C1 6666-1-14 [1,0,0,0,1,0|2,0,0]=4 62 B12R1.30 O=C(CCCCl)C1=CC=CC=C1 2617-5-Z5 [1,0,0,0,1,0|2,0,0]=4 63 B12R1.30 O=C(NCCCl)C1=CC=CC=C1 4648-5-2H [1,0,0,0,1,0|2,0,0]=4 64 B12R1.30 O=C(OCCBr)C1=CC=CC=C1 2623-9-0A [1,0,0,0,1,0|1,0,0]=3 65 B12R1.30 O=C(OCCCl)C1=CC=CC=C1 2623-5-0K [1,0,0,0,1,0|1,0,0]=3 66 B12R1.30 O=C(OCCO)C1=CC=CC=C1 2629-1-0R [1,0,0,0,1,0|1,0,0]=3 67 B12R1.252 CC(C)CNCC1=CC=CC=C1 3631-1-0U [1,0,0,0,1,0|1,0,0]=3 68 B12R1.252 CC(F)CSCC1=CC=CC=C1 5666-3-0B [1,0,0,0,1,0|1,1,0]=4 69 B12R1.252 C[C@@H](O)COCC1=CC=CC=C1 2607-1-R4 [1,0,0,0,1,0|1,0,0]=3 70 B12R1.107 CC(C)CC(=O)C1=CC=CC=C1 2617-1-1Z [0,0,0,0,2,0|0,0,0]=2 71 B12R1.107 CC(C)CC(=O)C1=NC=CC=C1 4H17-1-9T [0,0,0,0,2,0|1,0,0]=3 72 B12R1.107 C[S+](C)CC(=O)C1=CC=CC=C1 6666-3-06 [0,0,0,0,2,0|1,0,0]=3 73 B12R1.43 CC(Br)C(=O)NC1=CC=CC=C1 4648-9-Y3 [0,0,0,0,2,0|2,0,0]=4 74 B12R1.43 CC(C)C(=O)CC1=CC=CC=C1 2617-1-2G [0,0,0,0,2,0|0,0,0]=2 75 B12R1.43 CC(C)C(=O)OC1=CC=CC=C1 2623-1-3U [0,0,0,0,2,0|1,0,0]=3 76 B12R1.43 CN(C)C(=O)CC1=CC=CC=C1 4648-1-4L [0,0,0,0,2,0|1,0,0]=3 77 B12R1.43 CN(C)C(=O)NC1=CC=CC=C1 4653-1-03 [0,0,0,0,2,0|2,0,0]=4 78 B12R1.43 CN(C)C(=S)CC1=CC=CC=C1 7667-1-0A [0,0,0,0,2,0|1,1,0]=4 79 B14R1.156 O=C(CCCBr)OCC1=CC=CC=C1 2623-9-40 [1,0,0,0,0,1|2,0,0]=4 80 B14R1.156 O=C(NCCO)OCC1=CC=CC=C1 4656-1-7P [1,0,0,0,0,1|2,0,0]=4