0 B13R1.718 COC(=O)N\N=C\C1=CC=CC=C1 4656-1-EB [0,0,0,0,0,0|3,0,1]=4 1 B12R1.8 CCCNCCC1=NC=CC=C1 3H31-1-D3 [1,0,0,0,0,0|2,0,1]=4 2 B12R1.252 N=C(N)NCCC1=CC=CC=C1 8664-1-28 [1,0,0,0,0,0|3,0,0]=4 3 B14R1.163 COC(=O)CN[C@@H](C)C1=CC=CC=C1 4658-1-S10 [0,1,0,0,0,0|3,0,0]=4 4 B14R1.163 COC(=O)CN[C@H](C)C1=CC=CC=C1 4658-1-R10 [0,1,0,0,0,0|3,0,0]=4 5 B14R1.520 N#CCC(=O)NCCC1=CC=CC=C1 4648-1-6D [0,1,0,0,0,0|1,0,1]=3 6 B14R1.743 COC(=O)CC(N)CC1=CC=CC=C1 4658-1-3V [0,1,0,0,0,0|2,0,0]=3 7 B14R1.756 COC(=O)[C@@H](N)CCC1=CC=CC=C1 4658-1-S1L [0,1,0,0,0,0|2,0,0]=3 8 B14R1.1025 COC(=O)CCCC1=CC=CC(F)=C1 2623-3-2M [0,1,0,0,0,0|2,0,0]=3 9 B14R2.19 O=C1CCN(CC2=CC=CC=C2)N1 4H48-1-02T [0,0,0,1,0,0|2,0,0]=3 10 B14R2.31 O=C1CCC1OCC2=CC=CC=C2 2617-1-0G [0,0,0,1,0,0|2,0,0]=3 11 B14R2.68 O=C1COC(C2=CC=CC=C2)CN1 4H48-1-WB [0,0,0,1,0,0|2,0,0]=3 12 B14R2.68 OC1CCC(C2=CC=CC=C2)CC1 2602-1-0B [0,0,0,1,0,0|1,0,2]=4 13 B12R1.27 COC(=O)CCC1=CC=CC=N1 4H58-1-466 [0,0,0,0,1,0|2,0,0]=3 14 B12R1.27 C[C@@H](CO)OCC1=CC=CC=C1 2607-1-S1 [0,0,0,0,1,0|2,0,1]=4 15 B12R1.27 NCC(=O)NCC1=CC=CC=C1 4648-1-6R [0,0,0,0,1,0|2,0,0]=3 16 B14R1.716 COC(=O)CCNCC1=CC=CC=C1 4758-1-0X [0,0,0,0,0,1|2,0,0]=3 17 B13R1.158 O=C(O)CCCC1=CC=CC=C1F 2721-3-1Q [1,1,0,0,0,0|2,0,0]=4 18 B13R1.11 COC(=O)CC(O)C1=CC=CC=C1 2629-1-3Y [0,1,0,0,1,0|1,0,0]=3 19 B13R1.14 COC(=O)CCC1=CC=C(C)C=C1 2723-1-1X [0,1,0,0,1,0|1,0,0]=3 20 B13R1.14 COC(=O)CCC1=CC=C(Cl)C=C1 2623-5-0S [0,1,0,0,1,0|1,0,0]=3 21 B13R1.14 COC(=O)CNC1=CC=C(Cl)C=C1 4658-5-0U [0,1,0,0,1,0|2,0,0]=4 22 B13R1.14 COC(=O)COC1=CC=C(N)C=C1 4630-1-2B [0,1,0,0,1,0|2,0,0]=4 23 B13R1.14 COC(=O)COC1=CC=C(O)C=C1 2623-1-1A [0,1,0,0,1,0|2,0,0]=4 24 B13R1.15 COC(=O)CCC1=CC=CC(Cl)=C1 2623-5-1E [0,1,0,0,1,0|1,0,0]=3 25 B13R1.135 COC(=O)[C@H](N)CC1=CC=CC=C1 4658-1-R1A [0,1,0,0,1,0|1,0,0]=3 26 B13R1.528 COC(=O)CCC1=C(Cl)C=CC=C1 2623-5-1F [0,1,0,0,1,0|1,0,0]=3 27 B13R1.528 COC(=O)CCC1=CC=CC=C1Br 2623-9-34 [0,1,0,0,1,0|1,0,0]=3 28 B13R1.528 COC(=O)CNC1=C(F)C=CC=C1 4631-3-0C [0,1,0,0,1,0|2,0,0]=4 29 B15R1.826 CCOC(=O)C(=O)NCC1=CC=CC=C1 4656-1-7Z [0,2,0,0,0,0|2,0,0]=4 30 B13R2.3 C1=CC=C([C@@H]2COCCN2)C=C1 4H56-5-RG [1,0,0,1,0,0|1,0,1]=4 31 B13R2.3 C1=CC=C([C@H]2COCCN2)C=C1 4H56-5-SG [1,0,0,1,0,0|1,0,1]=4 32 B13R2.32 CN1C(=O)OCC2=CC=CC=C21 4H56-1-06G [0,0,0,1,1,0|1,0,0]=3 33 B15R2.79765 COC(=O)C1CCCC2=C1C=CC=C2 2623-1-3R [0,0,0,1,0,1|2,0,0]=4 34 B15R2.98 CC1=CC=C(CN2CCC(=O)N2)C=C1 4H48-1-02V [0,1,0,1,0,0|2,0,0]=4 35 B15R2.297 O=C1CCC(C(O)C2=CC=CC=C2)O1 2H25-1-1V [0,1,0,1,0,0|0,0,0]=2 36 B15R2.19402 COC(=O)C1(N)CCC2=CC=CC=C21 4658-5-30 [0,1,0,1,0,0|2,0,0]=4 37 B15R2.308 O=C1COC(C2=CC=CC=C2Cl)CN1 4H48-5-CD [0,1,0,1,0,0|2,0,0]=4 38 B15R3.485 O=C1N[C@@H]2C3=CC=CC=C3CC[C@H]12 4H48-1-FF [0,0,0,2,0,0|2,0,0]=4 39 B11R1.91 NC(=O)CCC1=CC=CC=N1 4H48-1-VK [1,0,0,0,1,0|2,0,0]=4 40 B11R1.91 NC(=O)CCC1=CC=CN=C1 4H48-1-VL [1,0,0,0,1,0|2,0,0]=4 41 B11R1.91 NC(=O)CCC1=CC=NC=C1 4H48-1-VM [1,0,0,0,1,0|2,0,0]=4 42 B11R1.91 O=C(Cl)CCC1=CC=CN=C1 4H16-5-67 [1,0,0,0,1,0|2,0,0]=4 43 B11R1.91 O=C(Cl)CNC1=CC=CC=C1 4631-5-00 [1,0,0,0,1,0|2,0,0]=4 44 B11R1.172 CC(=O)NCCN1C=CC=C1 4H48-1-01X [1,0,0,0,1,0|2,0,0]=4 45 B11R1.25 COC(=O)CCC1=CC=CN1 4H23-1-8N [0,0,0,0,2,0|2,0,0]=4 46 B11R1.25 COC(=O)CCN1C=CC=C1 4H23-1-JH [0,0,0,0,2,0|2,0,0]=4 47 B11R1.40 CNC(=O)OC1=CC=CC=C1 4656-1-7R [0,0,0,0,2,0|1,0,0]=3