0 B6R0.3 CC(CN)N(C)C BB12-3256 [0,0,0,0,0,0|4,0,0]=4 1 B6R0.3 CC(CO)[N+](=O)[O-] BB12-1675 [0,0,0,0,0,0|4,0,0]=4 2 B6R0.3 CSC(C)C(=O)O BB12-2671 [0,0,0,0,0,0|3,0,0]=3 3 B5R0.1 CCOC(C)=N BB12-3674 [1,0,0,0,0,0|2,0,0]=3 4 B5R0.1 CNCC(C)=O BB12-3010 [1,0,0,0,0,0|1,0,0]=2 5 B5R0.1 CNCC(C)O BB12-1288 [1,0,0,0,0,0|1,0,2]=4 6 B5R0.3 CCC(C)NC BB53-1672 [1,0,0,0,0,0|2,0,0]=3 7 B5R0.3 CNC(C)CO BB12-1570 [1,0,0,0,0,0|3,0,0]=4 8 B5R0.3 [C-]#[N+]C(C)CC BB56-1204 [1,0,0,0,0,0|2,0,1]=4 9 B5R0.5 CC(Cl)C(N)=O BB12-1307 [1,0,0,0,0,0|2,0,0]=3 10 B7R0.5 CC(CCN)N(C)C BB12-1370 [0,1,0,0,0,0|3,0,0]=4 11 B7R0.5 CC(CCO)N(C)C BB12-3646 [0,1,0,0,0,0|3,0,0]=4 12 B7R0.5 CCSC(C)C(=O)O BB12-3261 [0,1,0,0,0,0|2,0,0]=3 13 B7R0.5 CNCC(C)C(=O)O BB12-1637 [0,1,0,0,0,0|2,0,0]=3 14 B7R0.10 CCN(C)C(=O)CCl BB12-2479 [0,1,0,0,0,0|2,0,0]=3 15 B7R0.10 CNC(=O)C(C)NC BB12-3606 [0,1,0,0,0,0|2,0,0]=3 16 B7R0.13 CCC(C)(N)C(=O)O BB56-0974 [0,1,0,0,0,0|2,0,0]=3 17 B7R0.15 CCC(CC)N(C)C BB12-3678 [0,1,0,0,0,0|3,0,0]=4 18 B7R0.15 CCC(CN)N(C)C BB12-3590 [0,1,0,0,0,0|3,0,0]=4 19 B7R0.15 CCC(CO)N(C)C BB12-3597 [0,1,0,0,0,0|2,1,0]=4 20 B7R0.16 CC(C(=O)O)N(C)C BB12-1429 [0,1,0,0,0,0|3,0,0]=4 21 B7R1.4 NC1CCNC1=O BB12-2184 [0,0,0,1,0,0|2,0,0]=3 22 B7R1.18 NC(=O)C1CCC1 BB12-3033 [0,0,0,1,0,0|2,0,0]=3 23 B7R0.2 CCN(C)CC(=O)O BB12-1321 [0,0,0,0,0,1|3,0,0]=4 24 B7R0.2 CCN(C)CC(C)=O BB12-2316 [0,0,0,0,0,1|2,0,0]=3 25 B7R0.2 CNC(C)CC(=O)O BB12-1285 [0,0,0,0,0,1|3,0,0]=4 26 B4R0.2 CSCCCl BB53-1396 [2,0,0,0,0,0|2,0,0]=4 27 B4R0.2 CSCCN BB12-0970 [2,0,0,0,0,0|2,0,0]=4 28 B6R0.1 C#CC(=O)OCC BB53-1426 [1,1,0,0,0,0|1,0,1]=4 29 B6R0.1 CCC\C(N)=N\O BB10-0037 [1,1,0,0,0,0|1,0,1]=4 30 B6R0.1 CNC(=O)CC#N BB12-1423 [1,1,0,0,0,0|1,0,1]=4 31 B6R0.1 CNC(=O)CCCl BB12-1619 [1,1,0,0,0,0|1,0,0]=3 32 B6R0.1 CNC(=O)CCN BB12-1715 [1,1,0,0,0,0|1,0,0]=3 33 B6R0.1 CNC(=O)CCO BB12-3660 [1,1,0,0,0,0|1,0,0]=3 34 B6R0.1 CNCC(=O)NN BB12-1497 [1,1,0,0,0,0|2,0,0]=4 35 B6R0.1 COC(=O)CCN BB12-2761 [1,1,0,0,0,0|1,0,0]=3 36 B6R0.1 COC(=O)CCO BB12-1300 [1,1,0,0,0,0|1,0,0]=3 37 B6R0.2 CC(N)CC(=O)O BB12-2890 [1,1,0,0,0,0|1,0,0]=3 38 B6R0.4 CCNCC(C)O BB12-1676 [1,1,0,0,0,0|0,0,2]=4 39 B6R0.4 CCSCC(=O)O BB12-3264 [1,1,0,0,0,0|1,0,0]=3 40 B6R0.4 CNCCC(=O)O BB12-1452 [1,1,0,0,0,0|1,0,0]=3 41 B6R0.4 COCCC(=O)Cl BB20-1617 [1,1,0,0,0,0|1,0,0]=3 42 B6R0.4 CSCCC(=N)N BB12-3715 [1,1,0,0,0,0|2,0,0]=4 43 B6R0.5 CS(=O)(=O)CCN BB53-1620 [1,1,0,0,0,0|2,0,0]=4 44 B6R0.5 CS(=O)(=O)CCO BB53-1360 [1,1,0,0,0,0|2,0,0]=4 45 B6R0.9 CCC(C#N)NC BB12-1702 [1,1,0,0,0,0|2,0,0]=4 46 B8R0.5 CCCC(N)CC(=O)O BB12-1701 [0,1,0,0,0,1|2,0,0]=4 47 B8R0.3 CCOC(=O)C(=O)CC BB12-2925 [0,2,0,0,0,0|0,1,1]=4 48 B8R0.8 CCCC[C@H](N)C(=O)O BB12-2277 [0,2,0,0,0,0|2,0,0]=4 49 B8R0.13 CCC(C)(N)C(=O)OC BB56-0964 [0,2,0,0,0,0|1,0,0]=3 50 B8R0.18 CCC(C(=O)O)N(C)C BB12-3549 [0,2,0,0,0,0|2,0,0]=4 51 B6R1.11 N=C(N)C1CC1 BB53-1675 [1,0,0,1,0,0|2,0,0]=4 52 B6R1.11 NC(=S)C1CC1 BB12-3485 [1,0,0,1,0,0|1,1,0]=4 53 B8R1.5 O=C1CCOCC1O BB17-2979 [0,1,0,1,0,0|0,1,0]=3 54 B8R1.5 O=C1OCCCC1Br BB17-3008 [0,1,0,1,0,0|1,0,0]=3 55 B8R1.7 NC(=O)[C@@H]1CCCN1 BB12-3488 [0,1,0,1,0,0|2,0,0]=4 56 B8R1.11 CCC1CCCC1=O BB12-2911 [0,1,0,1,0,0|1,0,0]=3 57 B8R1.38 COC(=O)C1CCC1 BB12-2967 [0,1,0,1,0,0|1,0,0]=3 58 B8R1.38 NNC(=O)C1CCC1 BB12-2674 [0,1,0,1,0,0|2,0,0]=4