0 B12R1.75 COC1=CC=CC=C1CC(C)N Y6066 [0,0,0,0,0,0|2,0,1]=3 1 B11R1.41 COC1=C(CCN)C=CC=C1 Y1181 [1,0,0,0,0,0|2,0,1]=4 2 B11R1.41 CSC1=CC=CC=C1N=C=O Y9328 [1,0,0,0,0,0|1,1,1]=4 3 B11R1.86 O=C(Cl)OC1=CC=CC=C1Cl 1026AP [1,0,0,0,0,0|2,0,0]=3 4 B13R1.589 CC(=O)OC1=CC=CC=C1C(=O)O I624 [0,1,0,0,0,0|2,0,0]=3 5 B13R1.3089 COC1=CC=C(C)C=C1NC(N)=S 2012AF [0,1,0,0,0,0|2,1,0]=4 6 B13R2.72 CC(=O)C1=CSC2=CC=CC=C21 E546 [0,0,0,1,0,0|1,1,1]=4 7 B13R2.328 NC1=CC(=O)OC2=C1C=CC=C2 8125AJ [0,0,0,1,0,0|2,0,1]=4 8 B13R2.581 COC1=C2CC(N)CC2=CC=C1 1898AC [0,0,0,1,0,0|2,0,1]=4 9 B13R2.581 COC1=C2NC(=S)OC2=CC=C1 6195AJ [0,0,0,1,0,0|2,0,1]=4 10 B11R1.53 CNC1=CC=CC=C1C(=O)O 8074AF [0,0,0,0,1,0|2,0,0]=3 11 B11R1.53 COC1=C(C(C)Br)C=CC=C1 1291AB [0,0,0,0,1,0|1,0,1]=3 12 B11R1.53 COC1=CC=CC=C1[C@@H](C)N W7850 [0,0,0,0,1,0|1,0,1]=3 13 B11R1.53 COC1=CC=CC=C1[C@H](C)N W7851 [0,0,0,0,1,0|1,0,1]=3 14 B11R1.53 CSC1=NC=CC=C1C(=O)O Y9981 [0,0,0,0,1,0|2,1,0]=4 15 B11R1.53 NNC1=CC=CC=C1C(=O)O Z1609 [0,0,0,0,1,0|3,0,0]=4 16 B11R1.53 O=C(O)C1=C([Hg]O)C=CC=C1 7844AF [0,0,0,0,1,0|3,0,0]=4 17 B10R1.4 CCOC1=CC=CC=C1S I213 [2,0,0,0,0,0|0,1,1]=4 18 B10R1.20 CCC1=C(CC)C=CC=C1 1495AL [2,0,0,0,0,0|1,0,1]=4 19 B10R1.20 COC1=CC=CC=C1NN 6140AD [2,0,0,0,0,0|2,0,0]=4 20 B10R1.20 COC1=CN=NC=C1OC 8058AB [2,0,0,0,0,0|2,0,0]=4 21 B10R1.20 CSC1=CC=CC=C1C=O I066 [2,0,0,0,0,0|0,1,0]=3 22 B12R1.169 CCOC1=CC=CC=C1CCN 2442AE [1,1,0,0,0,0|1,0,1]=4 23 B12R1.124 NC(C(=O)O)C1=CC=CC=C1O W4840 [1,1,0,0,0,0|2,0,0]=4 24 B12R1.224 CC(=O)NC1=CC=CC(N)=C1F Y6271 [1,1,0,0,0,0|2,0,0]=4 25 B12R1.233 O=C(O)CC1=CC=C(O)C=C1O W1999 [1,1,0,0,0,0|2,0,0]=4 26 B12R1.1009 CC(=O)NC1=C(O)N=CC=C1O 8861AJ [1,1,0,0,0,0|2,0,0]=4 27 B12R1.46 CNC1=C(C(N)=O)C=C(Cl)C=C1 0067AE [0,1,0,0,1,0|2,0,0]=4 28 B12R1.46 CSC1=NC=C(F)C=C1C(C)=O Y5004 [0,1,0,0,1,0|1,1,0]=4 29 B12R1.57 COC1=C(C(=N)N)C=CC(Br)=C1 2694AJ [0,1,0,0,1,0|2,0,0]=4 30 B12R1.87 CSC1=C(Br)C=CC=C1C(=O)O Z0641 [0,1,0,0,1,0|1,1,0]=4 31 B12R1.261 CC(N)C1=C(C(=O)O)C=CC=C1 9994AH [0,1,0,0,1,0|2,0,0]=4 32 B12R1.437 COC1=CC=CC(F)=C1C(N)=O 7496AB [0,1,0,0,1,0|1,0,0]=3 33 B14R1.3302 CNC(=O)OC1=C(C(C)C)C=CC=C1 Q530 [0,2,0,0,0,0|1,0,0]=3 34 B14R1.814 CC(C)OC1=CC=CC=C1OC(C)C X7908 [0,2,0,0,0,0|1,0,1]=4 35 B12R1.125 CC(=O)OCC1=C(C)C=CC=C1 5689AF [0,0,1,1,0,0|1,0,1]=4 36 B12R2.18 CN1C(=S)OC2=CC=CC=C21 Y7468 [1,0,0,1,0,0|1,1,0]=4 37 B12R2.18 O=C1OC2=C(C=CC=C2)C1=O 6525AJ [1,0,0,1,0,0|2,0,0]=4 38 B12R2.95 O=P1(Cl)OC2=C(C=CC=C2)O1 7483AA [1,0,0,1,0,0|2,0,0]=4 39 B12R2.202 CC1=CC2=C(O1)C(N)=CC=C2 8732AD [1,0,0,1,0,0|2,0,0]=4 40 B14R2.781 NC(=S)C1COC2=CC=CC=C2O1 Y7566 [0,0,0,1,0,1|1,1,0]=4 41 B14R2.741 N[C@H]1CCC2=CC=CC=C2NC1=O 8694AH [0,1,0,1,0,0|2,0,0]=4 42 B14R2.11647 COC1=CC=CC2=C1N=C(CCl)S2 7915AJ [0,1,0,1,0,0|1,1,0]=4 43 B14R2.28454 O=C1CCCC2=C(C=CC=C2F)N1 3375AH [0,1,0,1,0,0|2,0,0]=4 44 B10R1.61 CC(=O)C1=C(Cl)C=CN=C1 Y2027 [1,0,0,0,1,0|2,0,0]=4 45 B10R1.61 O=C([O-])C1=CC=CC=C1O M628 [1,0,0,0,1,0|1,0,0]=3 46 B10R1.61 O=C([O-])C1=CC=CC=C1O W0024 [1,0,0,0,1,0|1,0,0]=3