0 B11R1.16 CCOC(=O)N1CCNCC1 SPC-t185 [0,0,0,1,0,0|2,0,0]=3 1 B11R1.16 CCOC(=O)[C@@H]1CCC=CO1 SPC-m630 [0,0,0,1,0,0|1,0,2]=4 2 B11R1.16 CCOC(=O)[C@@H]1CNCCN1 SPC-t477 [0,0,0,1,0,0|2,0,0]=3 3 B11R1.16 CCOC(=O)[C@@H]1COCCN1 SPC-f087 [0,0,0,1,0,0|2,0,0]=3 4 B11R1.16 CCOC(=O)[C@@H]1CSCCN1 SPC-f062 [0,0,0,1,0,0|2,0,0]=3 5 B11R1.30 CCOC(=O)C[C@H]1CCNC1 SPC-t173 [0,0,0,1,0,0|1,0,0]=2 6 B11R1.112 CCOC(=O)[C@@H]1C[C@H]1CC#N SPC-n395 [0,0,0,1,0,0|1,0,1]=3 7 B11R1.199 CCOC(=O)[C@@H]1CCNC1=O SPC-n383 [0,0,0,1,0,0|2,0,1]=4 8 B11R1.289 CCOC(=O)C#CC1COC1 SPC-v502 [0,0,0,1,0,0|1,0,2]=4 9 B8R0.1 CCC#CC(=O)OCC SPC-t629 [2,0,0,0,0,0|0,0,2]=4 10 B10R1.11 CCOC(=O)[C@H]1CCNC1 SPC-k254 [1,0,0,1,0,0|1,0,0]=3 11 B10R1.11 CCOC(=O)[C@H]1CCNC1 SPC-u410 [1,0,0,1,0,0|1,0,0]=3 12 B10R1.135 CCOC(=O)C1CC1C#N SPC-h586 [1,0,0,1,0,0|1,0,1]=4 13 B10R1.135 CCOC(=O)C1CC1CO SPC-n385 [1,0,0,1,0,0|1,0,0]=3 14 B10R1.137 CCOC(=O)C=C1CCC1 SPC-a266 [1,0,0,1,0,0|0,0,2]=4 15 B10R1.2 CN1C(=O)CCC[C@@H]1CN SPC-k077 [1,0,0,1,0,0|2,0,0]=4 16 B10R1.15 CNC(=O)[C@@H]1CCCNC1 SPC-n750 [1,0,0,1,0,0|2,0,0]=4 17 B10R1.15 CNC(=O)[C@H]1CCCNC1 SPC-s691 [1,0,0,1,0,0|2,0,0]=4 18 B10R1.15 COC(=O)C1CCSCC1 SPC-n459 [1,0,0,1,0,0|1,0,0]=3 19 B10R1.15 COC(=O)[C@@H]1CC=CCC1 SPC-t652 [1,0,0,1,0,0|0,0,2]=4 20 B10R1.15 COC(=O)[C@@H]1CCCNC1 SPC-n418 [1,0,0,1,0,0|1,0,0]=3 21 B10R1.15 COC(=O)[C@H]1CCCNC1 SPC-q075 [1,0,0,1,0,0|1,0,0]=3 22 B10R1.15 COC(=O)[C@H]1CCCOC1 SPC-m559 [1,0,0,1,0,0|1,0,0]=3 23 B10R1.15 COC(=O)[C@H]1CNCCN1 SPC-q070 [1,0,0,1,0,0|2,0,0]=4 24 B10R1.149 COC(=O)[C@@H]1CCCC1=O SPC-g665 [1,0,0,1,0,0|1,0,1]=4 25 B10R1.149 COC(=O)[C@@H]1NCC[C@@H]1O SPC-j829 [1,0,0,1,0,0|2,0,0]=4 26 B10R1.149 COC(=O)[C@@H]1NCC[C@H]1O SPC-k055 [1,0,0,1,0,0|2,0,0]=4 27 B10R1.149 COC(=O)[C@H]1CNC[C@@H]1C SPC-r293 [1,0,0,1,0,0|1,0,0]=3 28 B10R1.149 COC(=O)[C@H]1NCC[C@@H]1O SPC-m240 [1,0,0,1,0,0|2,0,0]=4 29 B12R1.32 CCOC(=O)C=C1CCOCC1 SPC-m556 [0,1,0,1,0,0|0,0,2]=4 30 B12R1.32 CCOC(=O)CC1CCOCC1 SPC-g689 [0,1,0,1,0,0|0,0,0]=2 31 B12R1.32 CCOC(=O)C[C@H]1CCCNC1 SPC-j986 [0,1,0,1,0,0|0,0,0]=2 32 B12R1.308 CCOC(=O)[C@@H]1OCCCC1=O SPC-t182 [0,1,0,1,0,0|1,0,1]=4 33 B12R1.316 CCOC(=O)[C@@H]1CNC[C@H]1OC SPC-t186 [0,1,0,1,0,0|1,0,0]=3 34 B12R1.1618 CCOC(=O)C[C@]1(O)CCNC1 SPC-o006 [0,1,0,1,0,0|1,0,0]=3 35 B12R1.17 CCOC(=O)C1CC(O)CCO1 SPC-r355 [0,1,0,1,0,0|1,0,0]=3 36 B12R1.17 CCOC(=O)[C@@H]1CC(=O)CCO1 SPC-r359 [0,1,0,1,0,0|1,0,1]=4 37 B12R1.17 CCOC(=O)[C@H]1CCCC(=O)C1 SPC-k237 [0,1,0,1,0,0|0,0,1]=3 38 B12R1.17 CCOC(=O)[C@H]1C[C@H](C)CCN1 SPC-t891 [0,1,0,1,0,0|1,0,0]=3 39 B12R1.34 CON(C)C(=O)C1CCCCC1 SPC-q212 [0,1,0,1,0,0|2,0,0]=4 40 B12R1.1595 CCOC(=O)C1(N)CCSCC1 SPC-m689 [0,1,0,1,0,0|1,0,0]=3 41 B12R1.16 CCOC(=O)C1CCC(O)CO1 SPC-n391 [0,1,0,1,0,0|1,0,0]=3 42 B12R1.16 CCOC(=O)N1CCC(=O)CC1 SPC-v690 [0,1,0,1,0,0|1,0,1]=4 43 B12R1.16 CCOC(=O)[C@@H]1CCC(=O)CO1 SPC-m225 [0,1,0,1,0,0|1,0,1]=4 44 B12R2.229 O=C1CCNC[C@@H]2CCCN12 SPC-q229 [0,0,0,2,0,0|2,0,0]=4 45 B12R2.8 O=C1NCCC12CCNCC2 SPC-p128 [0,0,0,2,0,0|2,0,0]=4 46 B12R2.1469 CCOC(=O)C12CNCC1C2 SPC-q012 [0,0,0,2,0,0|1,0,0]=3 47 B12R2.1488 CCOC(=O)C1CC2CC2C1 SPC-h011 [0,0,0,2,0,0|0,0,0]=2 48 B12R2.5121 O=C1CCOC2(CCCC2)C1 SPC-p824 [0,0,0,2,0,0|2,0,0]=4