0 B9R0.1 CC[C@H](C)CCCC(C)C T70540 [1,0,0,0,0,0|2,0,1]=4 1 B9R0.2 CC(C)CCCCCCO D98911 [1,0,0,0,0,0|2,0,1]=4 2 B9R0.5 CCOC(=O)CCCNC AB10379 [1,0,0,0,0,0|3,0,0]=4 3 B11R1.15 CCOC(=O)C1CCC(F)C1 AC4965 [0,0,0,1,0,0|3,0,0]=4 4 B11R1.15 CCOC(=O)[C@@H]1CC[C@H](C)N1 C16215 [0,0,0,1,0,0|3,0,0]=4 5 B11R1.15 CCOC(=O)[C@@H]1CC[C@H](C)N1 Y10153 [0,0,0,1,0,0|3,0,0]=4 6 B11R1.15 NCCC(=O)N1CC[C@H](O)C1 C77812 [0,0,0,1,0,0|3,0,0]=4 7 B11R1.290 CCOC(=O)CCNC1CC1 AC6776 [0,0,0,1,0,0|3,0,0]=4 8 B9R0.48 CCOC(=O)\C=C\C(C)C W15771 [0,0,0,0,1,0|1,0,2]=4 9 B11R0.176 CCOC(=O)CCCCN(C)C AC6409 [0,0,0,0,0,1|3,0,0]=4 10 B8R0.6 CNC(=O)OCCCN AT13711 [2,0,0,0,0,0|2,0,0]=4 11 B8R0.28 C=C(C)CCCC(C)C T70747 [2,0,0,0,0,0|2,0,0]=4 12 B8R0.28 CC(=O)CCCN(C)C AC6136 [2,0,0,0,0,0|2,0,0]=4 13 B8R0.28 CC(C)CCOC(=O)Cl AC2336 [2,0,0,0,0,0|1,0,0]=3 14 B10R0.60 C[N+](C)(C)CCOC(=O)CBr D86709 [1,1,0,0,0,0|2,0,0]=4 15 B10R0.4 CC(C)CCCCCCCO D98228 [1,1,0,0,0,0|1,0,1]=4 16 B10R0.1 CCOC(=O)CCCCCN 77390 [1,1,0,0,0,0|2,0,0]=4 17 B10R0.1 CCOC(=O)COCCCO S11911 [1,1,0,0,0,0|2,0,0]=4 18 B10R0.2 CCCC(=O)CC(=O)CCC AC4162 [1,1,0,0,0,0|1,0,1]=4 19 B10R0.2 CCC[C@H](N)CC(=O)OCC N12292 [1,1,0,0,0,0|2,0,0]=4 20 B10R0.26 CCOC(=O)C[C@H](N)C(C)C F53416 [0,1,0,0,1,0|1,0,0]=3 21 B10R0.32 CCOC(=O)C(=O)CC(C)C 25233 [0,1,0,0,1,0|1,0,1]=4 22 B12R0.95 CCCOC(=O)NCCCN(C)C A12333 [0,1,0,0,0,1|2,0,0]=4 23 B12R0.140 CN(C)CCOC(=O)NC(C)(C)C AB10237 [0,2,0,0,0,0|2,0,0]=4 24 B10R1.13 CC(C)[C@H]1C=CC(=O)CC1 AT12689 [1,0,0,1,0,0|1,0,1]=4 25 B10R1.150 CCC(=O)NC1CC(N)C1 72861 [1,0,0,1,0,0|2,0,0]=4 26 B10R1.18 CC(C)C[C@H]1CNCCO1 F16046 [1,0,0,1,0,0|1,0,1]=4 27 B10R1.11 NCCC(=O)N1CCCC1 C78391 [1,0,0,1,0,0|2,0,0]=4 28 B10R1.11 O=C(CCCl)N1CCCC1 C78373 [1,0,0,1,0,0|2,0,0]=4 29 B10R1.29 CCCC[C@H]1CCCC1=O O10708 [1,0,0,1,0,0|1,0,0]=3 30 B10R1.137 CCNC(=O)OC1CNC1 AT23015 [1,0,0,1,0,0|2,0,0]=4 31 B10R1.138 CNCC(=O)NCC1CC1 70891 [1,0,0,1,0,0|2,0,0]=4 32 B10R1.30 CCN1C[C@H](C)NCC1=O F19820 [0,0,0,1,1,0|2,0,0]=4 33 B10R1.59 CC(C)[C@@H]1NC(=O)C[C@H]1O W16067 [0,0,0,1,1,0|2,0,0]=4 34 B10R1.63 CC1=CC(=O)CCC1(C)C 90807 [0,0,0,1,1,0|0,0,2]=4 35 B10R1.113 CC(C)N1CCCC(=O)C1 62868 [0,0,0,1,1,0|1,0,0]=3 36 B10R1.113 CC(C)[C@@H]1CC(=O)CCN1 70965 [0,0,0,1,1,0|1,0,0]=3 37 B10R1.113 CN(C)[C@H]1CCCC(=O)C1 D73606 [0,0,0,1,1,0|1,0,0]=3 38 B10R1.140 CC1CC(C(=O)CC#N)C1 C93308 [0,0,0,1,1,0|1,0,1]=4 39 B10R1.140 CCOC(=O)C1CC(F)C1 C93311 [0,0,0,1,1,0|2,0,0]=4 40 B10R1.140 CCOC(=O)C1CC(I)C1 93588 [0,0,0,1,1,0|2,0,0]=4 41 B12R1.17 CCOC(=O)C1CC(O)CCO1 P16697 [0,0,0,1,0,1|2,0,0]=4 42 B12R1.17 CCOC(=O)[C@@H]1C[C@@H](C)CCN1 27305 [0,0,0,1,0,1|2,0,0]=4 43 B12R1.310 CCOC(=O)CCNCC1CC1 C77564 [0,0,0,1,0,1|2,0,0]=4 44 B12R1.101 CC(C)CC1CC(=O)CC(=O)C1 F17098 [0,1,0,1,0,0|1,0,1]=4 45 B12R2.1488 CCOC(=O)C1CC2CC2C1 P15486 [0,0,0,2,0,0|2,0,0]=4 46 B12R2.2299 N[C@H]1CCN(C(=O)C2CC2)C1 C72165 [0,0,0,2,0,0|2,0,0]=4 47 B8R0.9 CC(C)CNC(=O)CN F21149 [1,0,0,0,1,0|2,0,0]=4 48 B8R0.5 CC(C)OC(=O)CCS FD10479 [0,0,0,0,2,0|1,0,0]=3 49 B8R0.5 CC(C)OC(=O)OCI D73860 [0,0,0,0,2,0|2,0,0]=4 50 B8R0.5 CCCC(=O)CC(C)C T72726 [0,0,0,0,2,0|0,0,0]=2 51 B8R0.5 CCOC(=O)C[C@H](C)N H11544 [0,0,0,0,2,0|2,0,0]=4 52 B8R0.5 CCOC(=O)C[S+](C)C AT26589 [0,0,0,0,2,0|2,0,0]=4