0 B17R2.5360 O=C1NC(=CC=C1OCC2=CC=CC=C2)I MCULE-6090682470 [1,0,0,0,0,0|3,0,0]=4 1 B17R2.5360 O=C1NC=C(C(=O)N1)NCC2=CC=CC=C2 MCULE-9532325370 [1,0,0,0,0,0|3,0,0]=4 2 B19R2.1025 N#CC1=CN(C(=O)NC1=O)OCC2=CC=CC=C2 MCULE-8304816663 [0,1,0,0,0,0|2,0,0]=3 3 B19R2.7716 O=C1NC(=O)N(C=C1F)C(=O)NC2=CC=CC=C2 MCULE-7835213649 [0,1,0,0,0,0|2,0,1]=4 4 B19R2.17337 NC1=C(N(C(=O)N=C1O)CCC2=CC=CC=C2)N MCULE-9784776096 [0,1,0,0,0,0|1,0,2]=4 5 B17R1.16303 CC(NC(=O)NCCC1=CC=CC=C1)C(=O)O MCULE-3418543275 [0,0,1,0,0,0|2,0,1]=4 6 B17R1.16303 C[C@H](NC(=O)NCCC1=CC=CC=C1)C(=O)O MCULE-6688236350 [0,0,1,0,0,0|2,0,1]=4 7 B17R2.5352 CC1=CN(C(=O)NC1=O)CC2=CC=CC=C2 MCULE-4654323255 [0,0,0,0,1,0|1,0,0]=2 8 B17R2.5352 CC1=NN(C(=O)NC1=O)CC2=CC=CC=C2 MCULE-9420882664 [0,0,0,0,1,0|2,0,0]=3 9 B17R2.5352 CC1=NN(C(=S)NC1=O)CC2=CC=CC=C2 MCULE-8414636150 [0,0,0,0,1,0|2,1,0]=4 10 B17R2.5352 CC1CN(C(=O)NC1=O)CC2=CC=CC=C2 MCULE-5710206772 [0,0,0,0,1,0|1,0,2]=4 11 B17R2.5352 O=C1NC(=O)N(C=C1Br)CC2=CC=CC=C2 MCULE-7952158260 [0,0,0,0,1,0|1,0,0]=2 12 B17R2.5352 O=C1NC(=O)N(C=C1Cl)CC2=CC=CC=C2 MCULE-4500054312 [0,0,0,0,1,0|1,0,0]=2 13 B17R2.5352 O=C1NC(=O)N(C=C1F)CC2=CC=CC=C2 MCULE-8255470577 [0,0,0,0,1,0|1,0,0]=2 14 B17R2.5352 O=C1NC(=O)N(C=C1I)CC2=CC=CC=C2 MCULE-5040635918 [0,0,0,0,1,0|1,0,0]=2 15 B19R2.7722 CC1=CN(C(=O)NC1=O)CCOC2=CC=CC=C2 MCULE-5628870697 [0,0,0,0,0,1|1,0,0]=2 16 B19R2.7722 CC1=CN(C(=O)NC1=O)COCC2=CC=CC=C2 MCULE-1556021239 [0,0,0,0,0,1|1,0,0]=2 17 B16R1.18213 O=C(O)C=CC(=O)NCCC1=CC=CC=C1 MCULE-4076517092 [1,0,1,0,0,0|2,0,0]=4 18 B16R1.12227 CC(=O)N(CCC1=CC=CC=C1)CC(=O)O MCULE-1764422595 [1,0,1,0,0,0|1,0,1]=4 19 B16R2.252 OC1=CC=CC(=C1)CCC2=CC=CC=C2 MCULE-4102666133 [2,0,0,0,0,0|2,0,0]=4 20 B16R2.71 O=C1C=CC=CN1CCC2=CC=CC=C2 MCULE-3381821818 [2,0,0,0,0,0|1,0,0]=3 21 B16R2.71 O=C1C=CC=CN1OCC2=CC=CC=C2 MCULE-2580209535 [2,0,0,0,0,0|2,0,0]=4 22 B16R2.71 O=C1NC=CC=C1OCC2=CC=CC=C2 MCULE-4894838269 [2,0,0,0,0,0|2,0,0]=4 23 B18R2.6540 O=C1C=NN(C(=O)N1)CC(=O)C2=CC=CC=C2 MCULE-8937437919 [1,1,0,0,0,0|1,0,1]=4 24 B18R2.38168 CC1=CC(=CC(=O)N1CCC2=CC=CC=C2)O MCULE-9289715703 [1,1,0,0,0,0|1,0,1]=4 25 B18R2.38168 NC1=CC(=O)NC(=O)N1CCC2=CC=CC=C2 MCULE-3905566451 [1,1,0,0,0,0|0,0,0]=2 26 B18R2.38168 NC1=CC(=O)NC(=S)N1CCC2=CC=CC=C2 MCULE-5976280757 [1,1,0,0,0,0|0,1,0]=3 27 B18R2.38168 O=C1CC(=O)N(C(=O)N1)CCC2=CC=CC=C2 MCULE-1261181335 [1,1,0,0,0,0|0,0,1]=3 28 B18R2.1623 N#CC1=CN(C(=O)NC1=O)CC2=CC=CC=C2 MCULE-8003918131 [0,1,0,0,1,0|1,0,0]=3 29 B18R2.1623 N#CC1=CN(C(=O)NC1=O)CC2=CC=NC=C2 MCULE-6668771428 [0,1,0,0,1,0|2,0,0]=4 30 B18R2.29863 CC1=CN(C(=O)NC1=O)CC2=CC=C(C=C2)Cl MCULE-1405044781 [0,1,0,0,1,0|1,0,0]=3 31 B18R2.38151 CC1=C(C(=O)N(C(=O)N1)CC2=CC=CC=C2)Cl MCULE-9750508004 [0,1,0,0,1,0|2,0,0]=4 32 B18R2.38151 CC1=C(C(=O)NC(=O)N1CC2=CC=CC=C2)Br MCULE-6621793568 [0,1,0,0,1,0|1,0,0]=3 33 B18R2.38151 NC1=C(C(=O)NC(=O)N1CC2=CC=CC=C2)Br MCULE-3234227981 [0,1,0,0,1,0|1,0,0]=3 34 B18R2.38151 NC1=C(C(=O)NC(=O)N1CC2=CC=CC=C2)Cl MCULE-8660680619 [0,1,0,0,1,0|1,0,0]=3 35 B18R2.38151 NC1=C(N(C(=O)NC1=O)CC2=CC=CC=C2)N MCULE-2217277498 [0,1,0,0,1,0|1,0,0]=3 36 B18R2.38151 NC1=C(NC(=O)N(C1=O)CC2=CC=CC=C2)O MCULE-4733769291 [0,1,0,0,1,0|1,0,1]=4 37 B18R2.38151 [NH3+]C1=C(N(C(=O)NC1=O)CC2=CC=CC=C2)[O-] MCULE-9944411099 [0,1,0,0,1,0|1,0,0]=3 38 B18R2.39530 CC1=CN(C(=O)NC1=O)CC2=C(C=CC=C2)C MCULE-2108556457 [0,1,0,0,1,0|1,0,0]=3 39 B18R2.131564 CC1=C(C(=O)N(C1=O)CCC2=CC=CC=C2)C MCULE-9948185740 [0,1,0,0,1,0|2,0,0]=4 40 B18R2.131564 O=C1C(=C(C(=O)N1CCC2=CC=CC=C2)Cl)Cl MCULE-1047771542 [0,1,0,0,1,0|2,0,0]=4 41 B18R2.63370 O=C1NC(=O)N(C1=O)OCC2=C(C=CC=C2)F MCULE-7806368777 [0,1,0,0,1,0|1,0,1]=4 42 B18R2.94068 O=C1NC(=O)N(C1=O)OCC2=CC=C(C=C2)Cl MCULE-4708214001 [0,1,0,0,1,0|1,0,1]=4 43 B18R2.94068 O=C1NC(=O)N(C1=O)OCC2=CC=C(C=C2)F MCULE-5439591958 [0,1,0,0,1,0|1,0,1]=4 44 B18R2.272727 O=C1NC(=O)N(C1=O)OCC2=CC=CC(=C2)Cl MCULE-5275999503 [0,1,0,0,1,0|1,0,1]=4 45 B20R2.8832 CC1=CN(C(=O)NC1=O)CNC(=O)C2=CC=CC=C2 MCULE-4441490269 [0,1,0,0,0,1|1,0,1]=4 46 B20R2.23150 CC1=C(C(=O)NC(=O)N1COCC2=CC=CC=C2)Br MCULE-7564145523 [0,1,0,0,0,1|1,0,0]=3 47 B20R2.240697 CC1=CC=C(C=C1)OCCN2C=C(C(=O)NC2=O)Br MCULE-4943602195 [0,1,0,0,0,1|1,0,0]=3 48 B20R2.240697 CC1=CN(C(=O)NC1=O)CCOC2=CC=C(C=C2)Cl MCULE-1365391878 [0,1,0,0,0,1|1,0,0]=3 49 B20R2.240697 O=C1NC(=O)N(C=C1Br)CCOC2=CC=C(C=C2)Cl MCULE-5342947457 [0,1,0,0,0,1|1,0,0]=3 50 B20R2.639566 CC1=CC(=CC=C1)OCCN2C=C(C(=O)NC2=O)C MCULE-1109835459 [0,1,0,0,0,1|1,0,0]=3 51 B20R2.19457 N#CC1=CN(C(=O)NC1=O)OCC2=CC=C(C=C2)Cl MCULE-2750217690 [0,2,0,0,0,0|2,0,0]=4 52 B20R2.63870 NC1=C(C(=O)NC(=O)N1CCC2=CC=CC=C2)N=O MCULE-6004423669 [0,2,0,0,0,0|0,0,1]=3 53 B18R2.30688 O=C1NC(=S)SC1=CNCCC2=CC=CC=C2 MCULE-9050470828 [0,0,1,1,0,0|0,2,0]=4 54 B18R3.108725 O=C1NC(=O)C2=C(N1)C3=CC=CC=C3CC2 MCULE-1001803142 [1,0,0,1,0,0|2,0,0]=4 55 B16R2.124 NC1=CN(C=CC1=O)CC2=CC=CC=C2 MCULE-9386275551 [1,0,0,0,1,0|2,0,0]=4 56 B16R2.124 O=C1C=CN(C=C1Br)CC2=CC=CC=C2 MCULE-8476389967 [1,0,0,0,1,0|2,0,0]=4 57 B16R2.312 O=C1C=C(C=CN1CC2=CC=CC=C2)Br MCULE-3031534976 [1,0,0,0,1,0|2,0,0]=4 58 B16R2.312 O=C1C=CN(C(=O)N1)CC2=CC=CC=C2 MCULE-2471984895 [1,0,0,0,1,0|0,0,0]=2 59 B16R2.312 O=C1C=NN(C(=O)N1)CC2=CC=CC=C2 MCULE-6657706374 [1,0,0,0,1,0|1,0,0]=3 60 B16R2.312 O=C1CCN(C(=O)N1)CC2=CC=CC=C2 MCULE-7312380065 [1,0,0,0,1,0|0,0,2]=4 61 B16R2.312 O=C1NC=C(C(=O)N1)CC2=CC=CC=C2 MCULE-1979598008 [1,0,0,0,1,0|2,0,0]=4 62 B16R2.2904 O=C1CN(C(=O)N1)NCC2=CC=CC=C2 MCULE-6366131166 [1,0,0,0,1,0|1,0,1]=4 63 B16R2.2904 O=C1NC(=O)C(N1)CCC2=CC=CC=C2 MCULE-4221939648 [1,0,0,0,1,0|2,0,0]=4 64 B16R2.317 NC1=CN(C(=O)C=C1)CC2=CC=CC=C2 MCULE-6603616018 [1,0,0,0,1,0|2,0,0]=4 65 B16R2.317 O=C1C=CC(=CN1CC2=CC=CC=C2)Br MCULE-2296977382 [1,0,0,0,1,0|2,0,0]=4 66 B16R2.317 O=C1N=CC(=CN1CC2=CC=CC=C2)Br MCULE-5427503526 [1,0,0,0,1,0|1,0,1]=4 67 B16R2.2948 O=C1C=CC(=O)N1CCC2=CC=CC=C2 MCULE-1378549216 [1,0,0,0,1,0|1,0,1]=4 68 B16R2.2948 O=C1NN=C(N1CCC2=CC=CC=C2)S MCULE-1333115423 [1,0,0,0,1,0|1,1,0]=4 69 B16R2.2900 O=C1NC(=O)N(C1=O)CC2=CC=CC=C2 MCULE-3935719785 [0,0,0,0,2,0|0,0,1]=3 70 B16R2.80306 O=C1NC(=O)N(C1=O)CCC2=CC=CS2 MCULE-2946831543 [0,0,0,0,2,0|1,0,1]=4 71 B18R2.4060 O=C1C=CN(C(=O)N1)CCOC2=CC=CC=C2 MCULE-2520762411 [1,0,0,0,0,1|0,0,0]=2 72 B18R2.4060 O=C1C=CN(C(=O)N1)COCC2=CC=CC=C2 MCULE-7641554382 [1,0,0,0,0,1|0,0,0]=2 73 B18R2.4060 O=C1NC=C(C(=O)N1)COCC2=CC=CC=C2 MCULE-1130745159 [1,0,0,0,0,1|2,0,0]=4 74 B18R2.4060 O=C1NC=C(C(=O)N1)NCCC2=CC=CC=C2 MCULE-8336536544 [1,0,0,0,0,1|2,0,0]=4