0 B10R1.475 CC1(NC(=O)NC1=O)CN Z3281869077 [0,0,0,0,0,0|2,0,2]=4 1 B10R1.475 CCC1(CC(=O)NC1=O)C Z384975088 [0,0,0,0,0,0|1,0,2]=3 2 B10R1.475 CCC1(NC(=O)CC1=O)C Z1510019271 [0,0,0,0,0,0|2,0,1]=3 3 B10R1.475 CCC1(NC(=O)NC1=O)C Z56862713 [0,0,0,0,0,0|1,0,2]=3 4 B10R1.475 C[C@@]1(NC(=O)NC1=O)CN Z3481525890 [0,0,0,0,0,0|2,0,2]=4 5 B10R1.475 C[C@]1(NC(=O)NC1=O)CN Z3481525884 [0,0,0,0,0,0|2,0,2]=4 6 B9R1.22 CCC1NC(=O)NC1=O Z270832922 [1,0,0,0,0,0|1,0,2]=4 7 B9R1.22 CCC1SC(=NC1=O)N Z57148419 [1,0,0,0,0,0|1,1,1]=4 8 B9R1.38 C=C1OC(=O)OC1(C)C Z1201620090 [1,0,0,0,0,0|2,0,0]=3 9 B9R1.38 CC1(CC(=O)NC1=O)C Z384975080 [1,0,0,0,0,0|1,0,2]=4 10 B9R1.38 CC1(NC(=O)CC1=O)C Z1258978079 [1,0,0,0,0,0|2,0,1]=4 11 B9R1.38 CC1(NC(=O)N=C1N)C Z1203586967 [1,0,0,0,0,0|2,0,0]=3 12 B9R1.38 CC1(NC(=O)NC1=O)C Z56766998 [1,0,0,0,0,0|1,0,2]=4 13 B9R1.38 CC1(OC(=O)NC1=O)C Z1255378932 [1,0,0,0,0,0|0,0,2]=3 14 B9R1.38 CC1(SC(=O)NC1=O)C Z1262691814 [1,0,0,0,0,0|0,1,2]=4 15 B9R1.125 CC1(CNC(=O)O1)CN Z5851683025 [1,0,0,0,0,0|1,0,2]=4 16 B9R1.125 CCC1(CNC(=O)C1)C Z1203748294 [1,0,0,0,0,0|1,0,2]=4 17 B11R1.419 CCC1(NC(=O)N(C1=O)N)C Z56930797 [0,1,0,0,0,0|1,0,2]=4 18 B11R1.419 CCC1(OC(=O)N(C1=O)C)C Z1198155421 [0,1,0,0,0,0|0,0,2]=3 19 B11R1.490 CC(C)C1(CC(=O)NC1=O)C Z384975176 [0,1,0,0,0,0|1,0,2]=4 20 B11R1.490 CC(C)C1(CC(=O)OC1=O)C Z166646974 [0,1,0,0,0,0|2,0,1]=4 21 B11R1.490 CC(C)C1(NC(=O)NC1=O)C Z240132170 [0,1,0,0,0,0|1,0,2]=4 22 B11R1.1050 CCC1(CC(=O)NC1=O)CC Z223460084 [0,1,0,0,0,0|1,0,2]=4 23 B11R1.1050 CCC1(CC(=O)OC1=O)CC Z223026192 [0,1,0,0,0,0|2,0,1]=4 24 B11R1.1050 CCC1(NC(=O)NC1=O)CC Z56862714 [0,1,0,0,0,0|1,0,2]=4 25 B11R1.1236 CCCC1(NC(=O)NC1=O)C Z285186408 [0,1,0,0,0,0|1,0,2]=4 26 B11R1.1236 COCC1(NC(=O)NC1=O)C Z992443698 [0,1,0,0,0,0|1,0,2]=4 27 B9R0.23 CCC(C)C(O)CC(=O)O Z982132268 [0,0,1,0,0,0|1,0,1]=3 28 B9R0.63 CCC(C)(CC)OC(=O)N Z1198155508 [0,0,1,0,0,0|1,0,2]=4 29 B11R2.621 O=C1CC2(CCC2)C(=O)N1 Z1198157427 [0,0,0,1,0,0|1,0,2]=4 30 B11R2.621 O=C1NC(=O)C2(N1)CCC2 Z364003304 [0,0,0,1,0,0|1,0,2]=4 31 B11R1.1180 CCC1(CC(=O)NC(=O)C1)C Z99599698 [0,0,0,0,0,1|1,0,2]=4 32 B11R1.1180 CCC1(CC(=O)OC(=O)C1)C Z104378230 [0,0,0,0,0,1|2,0,1]=4 33 B8R0.5 CCC/C(=C/C(=O)O)/C Z352746820 [1,0,1,0,0,0|2,0,0]=4 34 B8R0.5 CCCC(O)CC(=O)O Z982132146 [1,0,1,0,0,0|1,0,1]=4 35 B8R0.9 CCC(C)CCC(=O)O Z955111774 [1,0,1,0,0,0|1,0,1]=4 36 B8R0.9 CCC(C)NCC(=O)O Z425484950 [1,0,1,0,0,0|2,0,0]=4 37 B8R0.9 CCC(C)OCC(=O)O Z839103364 [1,0,1,0,0,0|2,0,0]=4 38 B8R0.34 CCC(C)(C)OC(=O)C Z1198150536 [1,0,1,0,0,0|1,0,1]=4 39 B8R1.1 CCC1=CN=C(O1)N Z994289172 [2,0,0,0,0,0|1,0,1]=4 40 B8R1.51 CC1(CCC(=O)O1)C Z854234982 [2,0,0,0,0,0|1,0,1]=4 41 B8R1.51 CC1(CNC(=O)O1)C Z1203730984 [2,0,0,0,0,0|0,0,2]=4 42 B10R1.59 CC(C)C1OC(=NC1=O)N Z57980337 [1,1,0,0,0,0|1,0,1]=4 43 B10R1.271 CN1C(=O)OC(C1=O)(C)C Z1201618106 [1,1,0,0,0,0|0,0,2]=4 44 B12R1.3817 CCC1(COC(=O)NC1=O)CC Z1198155402 [0,1,0,0,0,1|0,0,2]=4 45 B10R1.64 CC\1CCC/C1=C\C(=O)O Z1205498287 [0,0,1,1,0,0|2,0,0]=4 46 B10R2.332 O=C1NCC2(O1)CCC2 Z1203749291 [1,0,0,1,0,0|0,0,2]=4 47 B12R2.5102 CC1(OC(=O)NC1=O)C2CC2 Z1262692708 [0,1,0,1,0,0|0,0,2]=4 48 B12R2.783 NC1=NC(=O)NC12CCCC2 Z1347846798 [0,1,0,1,0,0|2,0,0]=4 49 B12R2.783 O=C1NC(=O)C2(O1)CCCC2 Z1262691957 [0,1,0,1,0,0|0,0,2]=4 50 B8R0.2 CC/C(=C(\C)/C(=O)O)/C Z1642058353 [0,0,1,0,1,0|1,0,1]=4 51 B8R0.2 CCC(C)C(=O)C(=O)O Z1205493610 [0,0,1,0,1,0|0,0,1]=3 52 B8R0.2 CCC(C)C(C)C(=O)O Z792363910 [0,0,1,0,1,0|1,0,1]=4 53 B8R0.2 CCC(C)C(N)C(=O)O Z104473608 [0,0,1,0,1,0|1,0,1]=4 54 B8R0.2 CC[C@@H](C)[C@@H](N)C(=O)O Z1203578023 [0,0,1,0,1,0|1,0,1]=4 55 B8R0.2 CC[C@@H](C)[C@H](N)C(=O)O Z1203578040 [0,0,1,0,1,0|1,0,1]=4 56 B8R0.2 CC[C@H](C)[C@@H](N)C(=O)O Z1201618644 [0,0,1,0,1,0|1,0,1]=4 57 B8R0.2 CC[C@H](C)[C@H](N)C(=O)O Z756427442 [0,0,1,0,1,0|1,0,1]=4 58 B8R0.2 COC(C)C(O)C(=O)O Z1509040637 [0,0,1,0,1,0|1,0,1]=4 59 B8R0.2 CSC(C)C(O)C(=O)O Z2787457174 [0,0,1,0,1,0|1,0,1]=4 60 B10R0.57 CCC(C)C(=O)NCC(=O)O Z239129928 [0,0,1,0,0,1|0,0,2]=4