0 B11R1.226 CCC(C)C1N=C(C(S1)C)C CNP0002810.0 [0,0,0,0,0,0|0,0,0]=0 1 B11R1.226 CC[C@H](C)C1=NC(=C(S1)C)C CNP0332845.1 [0,0,0,0,0,0|0,0,2]=2 2 B10R1.58 CC1=C(OC(=N1)C(C)C)C CNP0140800.0 [1,0,0,0,0,0|0,1,2]=4 3 B10R1.58 CC1=C(SC(=N1)C(C)C)C CNP0271534.0 [1,0,0,0,0,0|0,0,2]=3 4 B10R1.58 CC1=NN(CC1C)C(C)C CNP0114658.0 [1,0,0,0,0,0|2,0,0]=3 5 B10R1.131 CCCC1=NC(=C(O1)C)C CNP0002747.0 [1,0,0,0,0,0|0,1,2]=4 6 B10R1.131 CCCC1=NC(=C(S1)C)C CNP0002544.0 [1,0,0,0,0,0|0,0,2]=3 7 B12R1.63 CCC(C)C1O[C@H]([C@@H](O1)CC)C CNP0272277.1 [0,1,0,0,0,0|1,1,1]=4 8 B10R0.46 CC[C@@H](C)SC(=O)[C@H](C)CC CNP0265928.1 [0,0,1,0,0,0|1,0,2]=4 9 B10R0.82 CC[C@H](C)COC(=O)C(C)C CNP0174044.1 [0,0,1,0,0,0|3,0,0]=4 10 B12R1.358 CCC(C)C1NC(SC(S1)C)C CNP0002496.0 [0,0,0,0,0,1|0,0,2]=3 11 B12R1.358 CCC(C)C1SC(NC(S1)C)C CNP0002495.0 [0,0,0,0,0,1|1,0,1]=3 12 B12R1.367 CC[C@H](C)C1=CC(=C(C=N1)C)C CNP0297045.1 [0,0,0,0,0,1|1,0,2]=4 13 B9R0.24 CCC(=O)CC[C@@H](C)CC CNP0210465.2 [1,0,1,0,0,0|2,0,0]=4 14 B9R0.24 CCC(=O)CC[C@H](C)CC CNP0210465.1 [1,0,1,0,0,0|2,0,0]=4 15 B9R0.24 CCC(=O)OC[C@@H](C)CC CNP0161389.1 [1,0,1,0,0,0|2,0,0]=4 16 B9R0.24 CCC(C)CCC(C)CC CNP0597985.0 [1,0,1,0,0,0|1,0,1]=4 17 B9R0.24 CC[C@@H](C)SS[C@H](C)CC CNP0145468.1 [1,0,1,0,0,0|1,0,1]=4 18 B9R0.1 CCC(C)CC=CC(C)C CNP0083062.0 [1,0,1,0,0,0|2,0,0]=4 19 B9R1.11 CC[C@@H](C)C1=NC=CS1 CNP0384217.1 [2,0,0,0,0,0|0,0,2]=4 20 B9R1.11 CC[C@@H](C)C1=NCCS1 CNP0290095.1 [2,0,0,0,0,0|0,0,2]=4 21 B9R1.11 CC[C@@H](C)[C@H]1SCSS1 CNP0352742.1 [2,0,0,0,0,0|2,0,0]=4 22 B9R1.35 CC1=CSC(=N1)C(C)C CNP0165450.0 [2,0,0,0,0,0|0,0,2]=4 23 B9R1.23 CCC1=NC(=C(S1)C)C CNP0002548.0 [2,0,0,0,0,0|0,0,2]=4 24 B9R1.23 CCC1N=C(C(S1)C)C CNP0002846.0 [2,0,0,0,0,0|0,0,0]=2 25 B11R1.48 CCC1=C(N=C(S1)C(C)C)C CNP0334003.0 [1,1,0,0,0,0|0,0,2]=4 26 B11R1.48 CCC1=C(SC(=N1)C(C)C)C CNP0002540.0 [1,1,0,0,0,0|0,0,2]=4 27 B11R1.80 CC1=NC(SC1C)CC(C)C CNP0202504.0 [1,1,0,0,0,0|0,0,0]=2 28 B11R1.187 CCCC1=NC(=C(S1)C)CC CNP0356020.0 [1,1,0,0,0,0|0,0,2]=4 29 B11R1.187 CCCC1=NC(=C(S1)CC)C CNP0002541.0 [1,1,0,0,0,0|0,0,2]=4 30 B13R1.1807 CC[C@@H](C)[C@@H]1N=C([C@@H](N=C1O)C)O CNP0578748.1 [0,1,0,0,0,1|2,0,0]=4 31 B11R2.684 CC1=C[C@H]2C[C@@H]1CC2(C)C CNP0132888.1 [1,0,0,1,0,0|2,0,0]=4 32 B11R1.74 CC1NC(SC(S1)C(C)C)C CNP0002498.0 [1,0,0,0,0,1|1,0,1]=4 33 B11R1.74 CC1NC(SC(S1)C)C(C)C CNP0025314.0 [1,0,0,0,0,1|0,0,2]=4 34 B11R1.34 CCC[C@@H]1S[C@@H](N[C@@H](S1)C)C CNP0251466.1 [1,0,0,0,0,1|1,0,1]=4