0 B17R2.41860 CC1=NN=C(N=C1O)NC2=CC=CC(=C2)F MCULE-8466440692 [0,0,0,0,0,0|3,0,1]=4 1 B16R2.131 CC1=CC(=CC=C1)CC2=NN=C(C=C2)Cl MCULE-5911780388 [1,0,0,0,0,0|2,0,1]=4 2 B16R2.131 CC1=CC=CC(=C1)CC2=CC=C(N=N2)O MCULE-1218088609 [1,0,0,0,0,0|1,0,2]=4 3 B16R2.131 ClC1=CC(=CC=C1)CC2=NN=C(C=C2)Cl MCULE-3256922534 [1,0,0,0,0,0|1,1,1]=4 4 B16R2.131 FC1=CC(=CC=C1)OC2=NC=C(C=C2)Br MCULE-3210239790 [1,0,0,0,0,0|3,0,0]=4 5 B16R2.131 NC1=CC=C(C=C1)CC2=CC=CC(=C2)F MCULE-3311986301 [1,0,0,0,0,0|3,0,0]=4 6 B16R2.131 NC1=CN=C(C=C1)OC2=CC(=CC=C2)F MCULE-3233137989 [1,0,0,0,0,0|3,0,0]=4 7 B16R2.131 OC1=CC=C(N=C1)OC2=CC=CC(=C2)F MCULE-4715523797 [1,0,0,0,0,0|2,0,1]=4 8 B16R2.131 OC1=NN=C(C=C1)CC2=CC=CC(=C2)Cl MCULE-6049747269 [1,0,0,0,0,0|0,1,2]=4 9 B16R2.251 CC1=CC(=NC=C1)CC2=CC(=NC=C2)F MCULE-1989746617 [1,0,0,0,0,0|3,0,0]=4 10 B16R2.251 OC1=NC(=NN=C1)NC2=CC=CC(=C2)F MCULE-1763518647 [1,0,0,0,0,0|2,0,1]=4 11 B16R2.2917 CC1=C(C=NC(=C1)C2=CC=CC(=C2)F)N MCULE-5494985329 [0,0,0,0,1,0|3,0,0]=4 12 B16R2.2917 CC1=C(N=NC(=C1)C2=CC(=CC=C2)F)Cl MCULE-5743819076 [0,0,0,0,1,0|2,0,1]=4 13 B16R2.2917 NC1=CC=C(C=C1O)C2=CC(=CC=C2)F MCULE-4791761102 [0,0,0,0,1,0|3,0,0]=4 14 B16R2.2917 NC1=NC=C(C=C1O)C2=CC(=CC=C2)F MCULE-2560010831 [0,0,0,0,1,0|2,0,1]=4 15 B16R2.2917 OC1=C(C=NC(=N1)C2=CC(=CC=C2)F)Br MCULE-8950365280 [0,0,0,0,1,0|3,0,0]=4 16 B16R2.25761 NC1=NN(C=C1Cl)CC2=CC=CC(=C2)F MCULE-2557532904 [0,0,0,0,1,0|3,0,0]=4 17 B15R2.29 ClC1=CC=C(N=N1)CC2=CC=CC=C2 MCULE-5518260508 [2,0,0,0,0,0|1,0,1]=4 18 B15R2.29 NC1=CC=C(N=C1)CC2=CC=CC=C2 MCULE-8488700743 [2,0,0,0,0,0|2,0,0]=4 19 B15R2.29 OC1=CC=C(N=C1)CC2=CC=CC=C2 MCULE-1803061281 [2,0,0,0,0,0|1,0,1]=4 20 B15R2.31 OC1=CC(=CC=C1)CC2=CC=CC=C2 MCULE-3911731207 [2,0,0,0,0,0|2,0,0]=4 21 B15R2.31 OC1=CC(=CN=C1)CC2=CC=CC=C2 MCULE-8506684689 [2,0,0,0,0,0|1,0,1]=4 22 B17R2.2670 COC1=CC=CC(=C1)C2=NNC(=O)C(=C2)C MCULE-9284269145 [0,1,0,0,1,0|2,0,0]=4 23 B17R2.150293 CN1C=C(C=C(C1=O)N)C2=CC=CC(=C2)F MCULE-1749265041 [0,1,0,0,1,0|2,0,0]=4 24 B17R2.3016 CCN1C(=O)NN=C1CC2=CC=CC(=C2)F MCULE-4225851368 [0,1,0,0,1,0|2,0,0]=4 25 B15R2.94 CC1=CC(=NNC1=O)C2=CC=CC=C2 MCULE-1734270242 [1,0,0,0,1,0|1,0,0]=3 26 B15R2.94 NC1=CC(=NNC1=O)C2=CC=CC=C2 MCULE-7178341775 [1,0,0,0,1,0|1,0,0]=3 27 B15R2.94 O=C1C=C(NNC1=O)C2=CC=CC=C2 MCULE-1288841335 [1,0,0,0,1,0|0,0,2]=4 28 B15R2.94 O=C1NN=C(C=C1Cl)C2=CC=CC=C2 MCULE-9936034002 [1,0,0,0,1,0|1,0,0]=3 29 B15R2.94 OC1=CC(=NN=C1Cl)C2=CC=CC=C2 MCULE-8389432340 [1,0,0,0,1,0|1,0,1]=4 30 B15R2.4083 O=C1CCC(=C1O)CC2=CC=CC=C2 MCULE-4608449277 [1,0,0,0,1,0|2,0,0]=4 31 B15R2.28 CC1=CC(=CC=C1)C2=NNC(=O)C=C2 MCULE-9031277664 [1,0,0,0,1,0|1,0,0]=3 32 B15R2.28 FC1=CC(=CC=C1)C2=NN=C(C=C2)Cl MCULE-3691333217 [1,0,0,0,1,0|1,0,1]=4 33 B15R2.28 NC1=CC(=CC=C1)C2=NNC(=O)C=C2 MCULE-9289444651 [1,0,0,0,1,0|1,0,0]=3 34 B15R2.28 NC1=CC=C(N=C1)C2=CC=CC(=C2)F MCULE-2612175210 [1,0,0,0,1,0|2,0,0]=4 35 B15R2.28 O=C1C=CC(=NN1)C2=CC(=CC=C2)Br MCULE-7067922535 [1,0,0,0,1,0|0,1,0]=3 36 B15R2.28 O=C1C=CC(=NN1)C2=CC(=CC=C2)Cl MCULE-9462277136 [1,0,0,0,1,0|0,1,0]=3 37 B15R2.28 O=C1C=CC(=NN1)C2=CC(=CC=C2)O MCULE-9058747539 [1,0,0,0,1,0|1,0,0]=3 38 B15R2.28 OC1=NN=C(C=C1)C2=CC(=CC=C2)F MCULE-8070108701 [1,0,0,0,1,0|0,0,2]=4 39 B15R2.28 S=C1C=CC(=NN1)C2=CC(=CC=C2)Br MCULE-1343097118 [1,0,0,0,1,0|0,2,0]=4 40 B15R2.28 S=C1C=CC(=NN1)C2=CC(=CC=C2)Cl MCULE-2345313857 [1,0,0,0,1,0|0,2,0]=4 41 B15R2.1115 NC1=NC(=NN1)CC2=CC(=CC=C2)F MCULE-3895067333 [1,0,0,0,1,0|2,0,0]=4 42 B15R2.1115 NC1=NN(C=C1)CC2=CC=CC(=C2)F MCULE-4536161321 [1,0,0,0,1,0|2,0,0]=4 43 B15R2.30 OC1=CC(=CC=C1)C2=CC(=CC=C2)F MCULE-5595737740 [1,0,0,0,1,0|2,0,0]=4 44 B15R2.30 OC1=CC(=CN=C1)C2=CC=CC(=C2)F MCULE-7731293848 [1,0,0,0,1,0|1,0,1]=4 45 B15R2.30 OC1=CC(=NC=C1)C2=CC(=CC=C2)F MCULE-2862731756 [1,0,0,0,1,0|1,0,0]=3 46 B17R2.215 FC1=CC=CC(=C1)COC2=NC=C(C=C2)Br MCULE-1522153770 [1,0,0,0,0,1|2,0,0]=4 47 B17R2.5300 FC1=CC=CC(=C1)COC2=CC(=CC=N2)Br MCULE-5607052216 [1,0,0,0,0,1|2,0,0]=4