0 B14R1.160 N=C(N)NNC(=O)C1=C(O)C=CC=C1 BB58-4566 [0,0,0,0,0,0|4,0,0]=4 1 B14R1.160 O=C(O)CNC(=O)C1=C(F)C=CC=C1 BB57-6783 [0,0,0,0,0,0|2,0,0]=2 2 B14R1.160 O=C(O)CSC(=O)C1=CC=CC=C1Cl BB57-1623 [0,0,0,0,0,0|2,0,0]=2 3 B13R1.45 NC(=O)CNC(=O)C1=CC=NC=C1 BB20-2196 [1,0,0,0,0,0|3,0,0]=4 4 B13R1.45 O=C(O)CCC(=O)C1=CC=CC=C1 BB17-2250 [1,0,0,0,0,0|0,0,0]=1 5 B13R1.45 O=C(O)CNC(=O)C1=CC=CC=C1 BB57-0205 [1,0,0,0,0,0|1,0,0]=2 6 B13R1.45 O=C(O)\C=C\C(=O)C1=CC=CC=C1 BB57-6624 [1,0,0,0,0,0|0,0,2]=3 7 B13R1.674 NCCNC(=O)C1=C(O)C=CC=C1 BB58-4693 [1,0,0,0,0,0|2,0,1]=4 8 B15R1.5815 COC(=O)CNC(=O)C1=CC=CC=C1C BB57-2487 [0,1,0,0,0,0|2,0,0]=3 9 B15R1.5815 O=C(OCC(O)CO)C1=CC=CC=C1O BB57-6575 [0,1,0,0,0,0|1,0,2]=4 10 B15R1.5822 O=C(O)CNC(=O)C1=C(Cl)C=C(Cl)C=C1 BB17-0994 [0,1,0,0,0,0|2,0,0]=3 11 B15R2.6 O=C(O)CCN1C=CC2=C1C=CC=C2 BB55-4542 [0,0,0,1,0,0|3,0,0]=4 12 B15R2.6 O=C(O)CCN1C=NC2=CC=CC=C21 BB01-4220 [0,0,0,1,0,0|3,0,0]=4 13 B15R2.629 O=C(O)CN1CC2=CC=CC=C2C1=O BB01-6641 [0,0,0,1,0,0|2,0,0]=3 14 B15R2.14951 O=C(O)C1=CC(=O)C2=C(C=CC=C2)O1 BB01-8278 [0,0,0,1,0,0|0,0,2]=3 15 B13R1.201 CC1=C(C(N)CC(=O)O)C=CC=C1 BB01-4631 [0,0,0,0,1,0|2,0,1]=4 16 B13R1.201 NC(CC(=O)O)C1=CC=CC=C1Cl BB01-4167 [0,0,0,0,1,0|2,0,1]=4 17 B15R1.256 CC1=CC=CC=C1NC(=O)CCC(=O)O BB57-1939 [0,0,0,0,0,1|1,0,0]=2 18 B15R1.256 O=C(O)\C=C\C(=O)NC1=C(Cl)C=CC=C1 BB57-4559 [0,0,0,0,0,1|1,0,2]=4 19 B15R1.8019 O=C(O)CCNC(=O)C1=C(Cl)C=CC=C1 BB55-6870 [0,0,0,0,0,1|1,0,0]=2 20 B12R1.30 CCCCC(=O)C1=CC=CC=C1 BB17-2231 [2,0,0,0,0,0|1,0,1]=4 21 B12R1.252 O=C(O)CCCC1=CC=CC=C1 BB01-6304 [2,0,0,0,0,0|0,0,1]=3 22 B12R1.252 O=C(O)CCSC1=CC=CC=C1 BB01-2140 [2,0,0,0,0,0|1,0,0]=3 23 B12R1.252 O=C(O)CNCC1=CC=CC=C1 BB20-0184 [2,0,0,0,0,0|1,0,1]=4 24 B12R1.252 O=C(O)CSCC1=CC=CC=C1 BB55-4653 [2,0,0,0,0,0|1,0,1]=4 25 B12R1.252 O=C(O)C\C=C\C1=CC=CC=C1 BB01-6174 [2,0,0,0,0,0|0,0,1]=3 26 B12R1.308 CCNC(=O)C1=C(O)C=CC=C1 BB57-4768 [2,0,0,0,0,0|1,0,1]=4 27 B14R1.415 CC(NC(=O)C1=CC=CC=C1)C(=O)O BB01-2572 [1,1,0,0,0,0|1,0,0]=3 28 B14R1.417 CN(CC(=O)O)C(=O)C1=CC=CC=C1 BB32-1432 [1,1,0,0,0,0|1,0,0]=3 29 B14R1.678 CC1=CC=C(C(=O)CCC(=O)O)C=C1 BB01-3416 [1,1,0,0,0,0|0,0,0]=2 30 B14R1.678 CC1=CC=C(C(=O)NCC(=O)O)C=C1 BB57-6782 [1,1,0,0,0,0|1,0,0]=3 31 B14R1.678 CC1=CC=C(C(=S)SCC(=O)O)C=C1 BB58-4658 [1,1,0,0,0,0|1,1,0]=4 32 B14R1.678 NC1=CC=C(C(=O)NCC(=O)O)C=C1 BB57-6781 [1,1,0,0,0,0|1,0,0]=3 33 B14R1.678 O=C(O)CCC(=O)C1=CC=C(F)C=C1 BB57-0209 [1,1,0,0,0,0|0,0,0]=2 34 B14R1.678 O=C(O)CNC(=O)C1=CC=C(Cl)C=C1 BB17-0993 [1,1,0,0,0,0|1,0,0]=3 35 B14R1.678 O=C(O)CNC(=O)C1=CC=C(F)C=C1 BB57-4790 [1,1,0,0,0,0|1,0,0]=3 36 B14R1.678 O=C(O)\C=C\C(=O)C1=CC=C(F)C=C1 BB57-7144 [1,1,0,0,0,0|0,0,2]=4 37 B14R1.337 O=C(O)CC(=O)NC1=CC=CC=C1O BB58-3150 [1,1,0,0,0,0|1,0,1]=4 38 B14R1.918 O=C(NCCO)C1=C(O)C=CC(O)=C1 BB55-7595 [1,1,0,0,0,0|1,0,1]=4 39 B14R1.1035 NCCCNC(=O)C1=C(O)C=CC=C1 BB58-4663 [1,1,0,0,0,0|1,0,1]=4 40 B14R1.840 COC1=CC=CC=C1C(N)CC(=O)O BB01-4659 [0,1,0,0,1,0|1,0,1]=4 41 B16R1.1369 CCC1=C(NC(=O)CCC(=O)O)C=CC=C1 BB57-1165 [0,1,0,0,0,1|1,0,0]=3 42 B16R1.1369 COC1=C(NC(=O)\C=C\C(=O)O)C=CC=C1 BB57-4555 [0,1,0,0,0,1|0,0,2]=4 43 B16R1.1369 CSC1=CC=CC=C1NC(=O)CCC(=O)O BB55-6290 [0,1,0,0,0,1|0,1,0]=3 44 B16R1.7488 CC1=CC=C(C)C(NC(=O)CCC(=O)O)=C1 BB57-1936 [0,1,0,0,0,1|1,0,0]=3 45 B16R1.7488 CC1=CC=C(F)C(NC(=O)CCC(=O)O)=C1 BB55-6294 [0,1,0,0,0,1|1,0,0]=3 46 B16R1.11019 O=C(O)CCS(=O)(=O)CC1=CC=CC=C1Cl BB01-1304 [0,1,0,0,0,1|2,0,0]=4 47 B16R1.11390 O=C(O)CCC(=O)NC1=C(F)C=C(Cl)C=C1 BB55-6303 [0,1,0,0,0,1|1,0,0]=3 48 B16R1.4547 O=C(O)CNC(=O)C1=CC=CC=C1[N+](=O)[O-] BB57-6609 [0,2,0,0,0,0|1,0,1]=4 49 B14R1.423 O=C(O)CCC(=O)NC1=CC=CC=C1 BB57-1164 [0,0,1,1,0,0|2,0,0]=4 50 B14R2.287 O=C1CNC(=O)C2=CC=CC=C2N1 BB01-2431 [1,0,0,1,0,0|2,0,0]=4 51 B14R2.25733 O=C1CC(C(=O)O)C2=C1C=CC=C2 BB01-8277 [1,0,0,1,0,0|0,0,0]=2 52 B14R2.781 O=C(O)C1COC2=CC=CC=C2O1 BB01-4055 [1,0,0,1,0,0|1,0,0]=3 53 B14R2.450 CC1=C(C(=O)O)OC2=C1C=CC=C2 BB55-0070 [0,0,0,1,1,0|1,0,1]=4 54 B16R2.36 O=C(O)CCCC1=CNC2=CC=CC=C12 BB57-0210 [0,0,0,1,0,1|2,0,0]=4 55 B16R2.16183 O=C(O)CN1C(=O)C2=C(C=CC=C2)C1=O BB01-6219 [0,1,0,1,0,0|1,0,1]=4 56 B16R2.12 NC(CC1=CNC2=C1C=CC=C2)C(=O)O BB57-0287 [0,1,0,1,0,0|2,0,0]=4 57 B16R2.4003 O=C(O)CCN1C(=O)OC2=C1C=CC=C2 BB55-6667 [0,1,0,1,0,0|1,0,0]=3 58 B12R1.54 O=C(O)CNC(=O)C1=CC=CS1 BB55-3553 [1,0,0,0,1,0|2,0,0]=4 59 B12R1.107 NC(=O)NC(=O)C1=CC=CC=C1 BB57-3696 [1,0,0,0,1,0|2,0,0]=4 60 B12R1.125 CC1=C(SCC(=O)O)C=CC=C1 BB58-4631 [1,0,0,0,1,0|2,0,0]=4 61 B12R1.125 O=C(O)CCC1=C(Cl)C=CC=C1 BB17-1418 [1,0,0,0,1,0|1,0,0]=3 62 B12R1.125 O=C(O)CCC1=C(F)C=CC=C1 BB57-4563 [1,0,0,0,1,0|1,0,0]=3 63 B12R1.125 O=C(O)COC1=C(Cl)C=CC=C1 BB55-0527 [1,0,0,0,1,0|2,0,0]=4 64 B12R1.125 O=C(O)COC1=CC=CC=C1Br BB55-0536 [1,0,0,0,1,0|2,0,0]=4 65 B12R1.125 O=C(O)\C=C\C1=C(F)C=CC=C1 BB01-2229 [1,0,0,0,1,0|1,0,1]=4 66 B12R1.125 O=C(O)\C=C\C1=CC=CC=C1Br BB55-6081 [1,0,0,0,1,0|1,0,1]=4 67 B12R1.125 O=C(O)\C=C\C1=CC=CC=C1Cl BB01-2911 [1,0,0,0,1,0|1,0,1]=4 68 B12R1.125 O=C(O)\C=C\C1=CC=CC=C1O BB57-6763 [1,0,0,0,1,0|0,0,1]=3 69 B12R1.124 O=C(O)C(=O)C1=C(Br)C=CC=C1 BB32-1433 [0,0,0,0,2,0|1,0,0]=3 70 B14R1.420 O=C(O)CCNC(=O)C1=CC=CC=C1 BB55-4750 [1,0,0,0,0,1|0,0,0]=2 71 B14R1.420 O=C(O)CSCC(=O)C1=CC=CC=C1 BB58-4358 [1,0,0,0,0,1|0,0,0]=2