0 B18R1.5063 CC(C)NCC(=O)C1=CC=C(C=C1)NS(=O)(=O)C MCULE-1548864388 [0,0,0,0,0,0|0,0,2]=2 1 B18R1.5063 CC(C)NCC(=O)C1=CC=C(C=C1)NS(=O)(=O)C MCULE-7154035589 [0,0,0,0,0,0|0,0,2]=2 2 B18R1.5063 CC(C)NCC(O)C1=CC=C(C=C1)NS(=O)(=O)C MCULE-3878563080 [0,0,0,0,0,0|0,0,0]=0 3 B18R1.5063 CC(C)NC[C@@H](O)C1=CC=C(C=C1)NS(=O)(=O)C MCULE-2473784228 [0,0,0,0,0,0|0,0,0]=0 4 B18R1.5063 CC(C)NC[C@@H](O)C1=CC=C(C=C1)NS(=O)(=O)C MCULE-4209284736 [0,0,0,0,0,0|0,0,0]=0 5 B18R1.5063 CC(C)NC[C@H](O)C1=CC=C(C=C1)NS(=O)(=O)C MCULE-4525474684 [0,0,0,0,0,0|0,0,0]=0 6 B18R1.5063 CC(C)[NH2+]CC(O)C1=CC=C(C=C1)NS(=O)(=O)C MCULE-8589076631 [0,0,0,0,0,0|0,0,1]=1 7 B18R1.5063 CN(C)CCC(=O)C1=CC=C(C=C1)NS(=O)(=O)C MCULE-6899538334 [0,0,0,0,0,0|2,0,2]=4 8 B18R1.5063 CN(C)CCC(=O)C1=CC=C(C=C1)NS(=O)(=O)C MCULE-7255974066 [0,0,0,0,0,0|2,0,2]=4 9 B17R1.4993 CC(=O)NC1=CC=C(C=C1)[C@@H](N)CCC(C)C MCULE-7557736986 [1,0,0,0,0,0|3,0,0]=4 10 B17R1.4993 CC(=O)NC1=CC=C(C=C1)[C@@H](N)CCC(C)C MCULE-7980109890 [1,0,0,0,0,0|3,0,0]=4 11 B17R1.4993 CC(=O)NC1=CC=C(C=C1)[C@H](N)CCC(C)C MCULE-6356327383 [1,0,0,0,0,0|3,0,0]=4 12 B17R1.4993 CC(=O)NC1=CC=C(C=C1)[C@H](N)CCC(C)C MCULE-6362346363 [1,0,0,0,0,0|3,0,0]=4 13 B17R1.4994 CC(C)CC[C@@H](N)C1=CC=C(C=C1)S(=O)(=O)C MCULE-8304156525 [0,0,0,0,1,0|2,0,0]=3 14 B17R1.4994 CC(C)CC[C@@H](N)C1=CC=C(C=C1)S(=O)(=O)C MCULE-8339635177 [0,0,0,0,1,0|2,0,0]=3 15 B17R1.4994 CC(C)CC[C@H](N)C1=CC=C(C=C1)S(=O)(=O)C MCULE-5221312442 [0,0,0,0,1,0|2,0,0]=3 16 B17R1.4994 CC(C)CC[C@H](N)C1=CC=C(C=C1)S(=O)(=O)C MCULE-6264075529 [0,0,0,0,1,0|2,0,0]=3 17 B17R1.4994 CN(C)CCC(O)C1=CC=C(C=C1)S(=O)(=O)C MCULE-2941991808 [0,0,0,0,1,0|2,0,0]=3 18 B17R1.8298 CC(C)OC(=O)C1=CC=C(C=C1)NS(=O)(=O)C MCULE-3732628505 [0,0,0,0,1,0|1,0,2]=4 19 B19R1.26140 CC(C)CCNC(=O)C1=CC=C(C=C1)NS(=O)(=O)C MCULE-6426081604 [0,0,0,0,0,1|1,0,2]=4 20 B16R1.24 CCCCOC1=CC=C(C=C1)NS(=O)(=O)C MCULE-4091111860 [2,0,0,0,0,0|2,0,0]=4 21 B16R1.908 CCNC(=O)C1=CC=C(C=C1)NS(=O)(=O)C MCULE-6357224460 [2,0,0,0,0,0|0,0,2]=4 22 B18R1.8806 CC1=CC(=CC=C1NS(=O)(=O)C)C(=O)NC(C)C MCULE-6422056353 [0,1,0,0,1,0|0,0,2]=4 23 B18R1.15936 CCS(=O)(=O)NC1=CC=C(C=C1)C(=O)NC(C)C MCULE-6935216577 [0,1,0,0,1,0|0,0,2]=4 24 B18R1.21205 CC(C)NS(=O)(=O)C1=CC=C(C=C1)NS(=O)(=O)C MCULE-4824040869 [0,1,0,0,1,0|1,0,1]=4 25 B18R1.97318 CC(C)NC(=O)C1=CC=C(C=C1)N(C)S(=O)(=O)C MCULE-5382240296 [0,1,0,0,1,0|0,0,2]=4 26 B16R1.1286 CC(C)CNCC1=CC=C(C=C1)S(=O)(=O)C MCULE-5537262069 [1,0,0,0,1,0|2,0,0]=4 27 B16R1.1468 CCCC[C@@H](N)C1=CC=C(C=C1)S(=O)(=O)C MCULE-6276829689 [1,0,0,0,1,0|2,0,0]=4 28 B16R1.1468 CCCC[C@@H](N)C1=CC=C(C=C1)S(=O)(=O)C MCULE-7296803353 [1,0,0,0,1,0|2,0,0]=4 29 B16R1.1468 CCCC[C@H](N)C1=CC=C(C=C1)S(=O)(=O)C MCULE-1172638034 [1,0,0,0,1,0|2,0,0]=4 30 B16R1.1468 CCCC[C@H](N)C1=CC=C(C=C1)S(=O)(=O)C MCULE-2490163503 [1,0,0,0,1,0|2,0,0]=4 31 B16R1.1282 CC(=O)NC1=CC=C(C=C1)[C@@H](N)CC(C)C MCULE-5970730598 [1,0,0,0,1,0|2,0,0]=4 32 B16R1.1282 CC(=O)NC1=CC=C(C=C1)[C@@H](N)CC(C)C MCULE-8271363711 [1,0,0,0,1,0|2,0,0]=4 33 B16R1.1282 CC(=O)NC1=CC=C(C=C1)[C@H](N)CC(C)C MCULE-4104560767 [1,0,0,0,1,0|2,0,0]=4 34 B16R1.1282 CC(=O)NC1=CC=C(C=C1)[C@H](N)CC(C)C MCULE-6654370188 [1,0,0,0,1,0|2,0,0]=4 35 B16R1.4542 CC(C)NCC(O)C1=CC=C(C=C1)N(=O)=O MCULE-4112207990 [1,0,0,0,1,0|1,0,0]=3 36 B16R1.4542 CC(C)NCC(O)C1=CC=C(C=C1)N(=O)=O MCULE-5460065237 [1,0,0,0,1,0|1,0,0]=3 37 B16R1.4542 CC(C)NC[C@@H](O)C1=CC=C(C=C1)[N+](=O)[O-] MCULE-3388744964 [1,0,0,0,1,0|1,0,1]=4 38 B16R1.4542 CC(C)NC[C@@H](O)C1=CC=C(C=C1)[N+](=O)[O-] MCULE-4740589684 [1,0,0,0,1,0|1,0,1]=4 39 B16R1.4542 CC(C)NC[C@H](O)C1=CC=C(C=C1)[N+](=O)[O-] MCULE-5128775917 [1,0,0,0,1,0|1,0,1]=4 40 B16R1.4542 CC(C)NC[C@H](O)C1=CC=C(C=C1)[N+](=O)[O-] MCULE-7072186348 [1,0,0,0,1,0|1,0,1]=4 41 B16R1.6930 CC(C)C[C@@H](N)C1=CC=C(C=C1)S(=O)(=O)C MCULE-4927951163 [0,0,0,0,2,0|1,0,0]=3 42 B16R1.6930 CC(C)C[C@@H](N)C1=CC=C(C=C1)S(=O)(=O)C MCULE-5231740319 [0,0,0,0,2,0|1,0,0]=3 43 B16R1.6930 CC(C)C[C@H](N)C1=CC=C(C=C1)S(=O)(=O)C MCULE-4713626981 [0,0,0,0,2,0|1,0,0]=3 44 B16R1.6930 CC(C)C[C@H](N)C1=CC=C(C=C1)S(=O)(=O)C MCULE-5443365021 [0,0,0,0,2,0|1,0,0]=3