0 B11R1.16 CCOC(=O)C1=NC=CC=N1 CS-W022718 [1,0,0,0,0,0|2,0,0]=3 1 B11R1.16 N#CCC(=O)C1=CC=CC=C1 CS-W004658 [1,0,0,0,0,0|2,0,1]=4 2 B13R1.352 CS(=O)(=O)CC(=O)C1=CC=CC=C1 CS-0079889 [0,1,0,0,0,0|3,0,0]=4 3 B13R2.328 O=C1CC2=C(C=CC=C2)C(=O)N1 CS-W006004 [0,0,0,1,0,0|2,0,1]=4 4 B13R2.328 O=C1NC2=CC=CC=C2C(=O)O1 CS-M0780 [0,0,0,1,0,0|2,0,1]=4 5 B13R2.12159 O=C1OS(=O)(=O)C2=CC=CC=C12 CS-0066044 [0,0,0,1,0,0|3,0,0]=4 6 B11R1.36 CC(=O)C(=O)C1=CC=CC=C1 CS-W019544 [0,0,0,0,1,0|1,0,1]=3 7 B11R1.36 O=C(C1=CC=CC=C1)C(F)F CS-0095863 [0,0,0,0,1,0|2,0,0]=3 8 B13R1.45 CN(C)\C=C\C(=O)C1=CC=CN=C1 CS-M1464 [0,0,0,0,0,1|3,0,0]=4 9 B13R1.348 CC(C)CC(=O)CC1=CC=CC=C1 CS-W022210 [0,0,0,0,0,1|1,0,0]=2 10 B10R1.15 COC(=O)C1=CC=NC=C1 CS-D1405 [2,0,0,0,0,0|1,0,0]=3 11 B10R1.15 COC(=O)C1=NC=CC=N1 CS-M2690 [2,0,0,0,0,0|2,0,0]=4 12 B10R1.17 CCNCC1=CC=CC=C1 CS-W013340 [2,0,0,0,0,0|1,0,1]=4 13 B12R1.16 CCOC(=O)C1=CC=C(C)C=C1 CS-W020602 [1,1,0,0,0,0|0,0,0]=2 14 B12R1.16 CCOC(=O)C1=CC=C(C)N=C1 CS-0040862 [1,1,0,0,0,0|1,0,0]=3 15 B12R1.16 CCOC(=O)C1=CC=C(F)C=C1 CS-W017810 [1,1,0,0,0,0|0,0,0]=2 16 B12R1.16 CCOC(=O)C1=CN=C(Cl)C=C1 CS-W002340 [1,1,0,0,0,0|1,0,0]=3 17 B12R1.16 CCOC(=O)C1=CNC(=O)C=C1 CS-0029520 [1,1,0,0,0,0|1,0,0]=3 18 B12R1.16 CCOC(=O)C1=NC=C(C)C=C1 CS-0019228 [1,1,0,0,0,0|1,0,0]=3 19 B12R1.16 O=C(CCCl)C1=CC=C(F)C=C1 CS-0031428 [1,1,0,0,0,0|2,0,0]=4 20 B12R1.17 CCNC(=O)C1=CC(Br)=CN=C1 CS-0046807 [1,1,0,0,0,0|2,0,0]=4 21 B12R1.17 CCOC(=O)C1=CC(Cl)=NC=C1 CS-W019303 [1,1,0,0,0,0|1,0,0]=3 22 B12R1.17 CCOC(=O)C1=NC(N)=CC=C1 CS-W005977 [1,1,0,0,0,0|1,0,0]=3 23 B12R1.308 CCNC(=O)C1=C(Br)C=CC=C1 CS-0037638 [1,1,0,0,0,0|1,0,0]=3 24 B12R1.308 CCOC(=O)C1=C(C)N=CC=C1 CS-W010821 [1,1,0,0,0,0|1,0,0]=3 25 B12R1.308 CCOC(=O)C1=CC=NN=C1C CS-W020487 [1,1,0,0,0,0|2,0,0]=4 26 B12R1.308 CCOC(=O)C1=NC=CC=C1Br CS-0041849 [1,1,0,0,0,0|1,0,0]=3 27 B12R1.27 C[C@@H](CO)NCC1=CC=CC=C1 CS-M1051 [1,1,0,0,0,0|1,0,1]=4 28 B12R1.20 CC(Br)C(=O)C1=CC=C(Br)C=C1 CS-W012184 [0,1,0,0,1,0|1,0,0]=3 29 B12R1.20 CC1=CC=C(C(=O)C(C)Br)C=C1 CS-0102565 [0,1,0,0,1,0|1,0,0]=3 30 B12R1.20 CC1=CC=C(C(=O)C(O)O)C=C1 CS-W019211 [0,1,0,0,1,0|2,0,0]=4 31 B12R1.265 CC(C)(C)OC(=O)N1C=CC=C1 CS-D0903 [0,1,0,0,1,0|1,0,0]=3 32 B14R1.678 CN(C)\C=C\C(=O)C1=CC=C(F)C=C1 CS-0045369 [0,1,0,0,0,1|2,0,0]=4 33 B14R1.425 CC(C)[C@@H](N)C(=O)NC1=NC=CC=C1 CS-0093601 [0,1,0,0,0,1|2,0,0]=4 34 B14R1.425 CC(C)[C@H](N)C(=O)NC1=NC=CC=C1 CS-0093602 [0,1,0,0,0,1|2,0,0]=4 35 B14R1.2 CC(C)NC(=O)C1=CC=C(C=O)C=C1 CS-W022186 [0,2,0,0,0,0|1,0,0]=3 36 B14R1.683 CC(C)(C)OC(=O)C1=CC=C(Br)C=C1 CS-0040641 [0,2,0,0,0,0|0,0,0]=2 37 B14R1.683 CC(C)(C)OC(=O)C1=CC=C(O)C=C1 CS-W023012 [0,2,0,0,0,0|0,0,0]=2 38 B14R1.6048 CC(C)OC(=O)C1=CN=C(Cl)N=C1Cl CS-0085444 [0,2,0,0,0,0|2,0,0]=4 39 B14R1.5966 CC(C)(C)OC(=O)C1=CC(Br)=CC=C1 CS-M2538 [0,2,0,0,0,0|0,0,0]=2 40 B14R1.5966 CC(C)(C)OC(=O)C1=CC=CC(I)=C1 CS-0102178 [0,2,0,0,0,0|0,0,0]=2 41 B14R1.5966 CC(C)(C)OC(=O)C1=NC=CC(Cl)=C1 CS-W023010 [0,2,0,0,0,0|1,0,0]=3 42 B14R1.5805 CC(C)NS(=O)(=O)C1=CC=CC=C1N CS-0078842 [0,2,0,0,0,0|2,0,0]=4 43 B12R1.75 CC(C)OC1=C(C=O)C=CC=N1 CS-0043832 [0,0,1,1,0,0|2,0,0]=4 44 B12R2.1081 O=C1CCCC2=C1C=NC=C2 CS-W022438 [1,0,0,1,0,0|2,0,0]=4 45 B12R2.1081 O=C1CCCC2=CC=CC=C12 CS-D0598 [1,0,0,1,0,0|1,0,0]=3 46 B14R2.29285 CC1(C)CCC(=O)C2=C1C=CC=C2 CS-0067919 [0,0,0,1,0,1|1,0,0]=3 47 B14R2.29496 CC1=CC(C)(C)NC2=C1C=CC=C2 CS-0046816 [0,1,0,1,0,0|2,0,0]=4 48 B10R1.11 CCOC(=O)C1=CC=NO1 CS-0044017 [1,0,0,0,1,0|2,0,0]=4 49 B10R1.11 CCOC(=O)C1=CN=CS1 CS-W005172 [1,0,0,0,1,0|2,0,0]=4 50 B10R1.11 CCOC(=O)C1=COC=N1 CS-D0848 [1,0,0,0,1,0|2,0,0]=4 51 B10R1.18 CC(C)NC1=CC=CC=C1 CS-W019925 [1,0,0,0,1,0|1,0,0]=3 52 B10R1.18 CC(C)OC1=CC=CN=C1 CS-0028731 [1,0,0,0,1,0|1,0,0]=3