0 B8R0.3 CCOC(=O)C(Br)CBr BB_SC-07193 [0,0,0,0,0,0|2,0,0]=2 1 B8R0.3 CCOC(=O)\C(Cl)=N\O BB_SC-03909 [0,0,0,0,0,0|3,0,1]=4 2 B8R0.3 [C@H](N)(CS)C(=O)OCC BB_NC-02280 [0,0,0,0,0,0|2,0,0]=2 3 B7R0.5 C=C(C)C(=O)OCC BB_SC-06809 [1,0,0,0,0,0|0,0,2]=3 4 B7R0.5 CCOC(=O)C(=O)Cl BB_SC-06434 [1,0,0,0,0,0|2,0,1]=4 5 B7R0.5 CCOC(=O)C(C)=O BB_SC-05733 [1,0,0,0,0,0|1,0,1]=3 6 B7R0.5 CCOC(=O)C(F)F BB_SC-04011 [1,0,0,0,0,0|2,0,0]=3 7 B7R0.5 CCOC(=O)C(N)=O BB_SC-07128 [1,0,0,0,0,0|2,0,1]=4 8 B7R0.5 CNCC(=O)N(C)C BB_SC-03467 [1,0,0,0,0,0|3,0,0]=4 9 B7R0.5 [C@@H](C)(O)C(=O)OCC BB_NC-02266 [1,0,0,0,0,0|1,0,0]=2 10 B7R0.7 CCCC(=O)CCC BB_SC-06946 [1,0,0,0,0,0|1,0,0]=2 11 B7R0.7 CCOC(=O)CC#N BB_SC-06620 [1,0,0,0,0,0|1,0,1]=3 12 B7R0.7 CCOC(=O)CNN BB_SC-02643 [1,0,0,0,0,0|2,0,0]=3 13 B7R0.7 CCOC(C)OCC BB_SC-07086 [1,0,0,0,0,0|2,0,1]=4 14 B7R0.7 C\C=C\C(=O)OCC BB_NC-02193 [1,0,0,0,0,0|0,0,2]=3 15 B7R0.10 COC(=O)C(=O)OC BB_SC-07155 [1,0,0,0,0,0|2,0,1]=4 16 B7R0.10 [C@H](N)(CO)C(=O)OC BB_NC-02218 [1,0,0,0,0,0|2,0,0]=3 17 B9R0.35 CCOC(=O)C(=O)OCC BB_SC-06837 [0,1,0,0,0,0|1,0,1]=3 18 B9R1.5 O=C1NCCCCC1Br BB_SC-09874 [0,0,0,1,0,0|2,0,0]=3 19 B9R1.15 O=CC1CCCCC1=O BB_SC-11422 [0,0,0,1,0,0|2,0,1]=4 20 B9R0.34 CCOC(=O)CC(=O)CCl BB_SC-06776 [0,0,0,0,0,1|2,0,1]=4 21 B6R0.1 C=CC(=O)OCC BB_SC-07096 [2,0,0,0,0,0|0,0,2]=4 22 B6R0.1 CCOC(=O)CBr BB_SC-06646 [2,0,0,0,0,0|1,0,0]=3 23 B6R0.1 CCOC(=O)CCl BB_SC-06777 [2,0,0,0,0,0|1,0,0]=3 24 B6R0.1 CCOC(=O)CS BB_SC-07162 [2,0,0,0,0,0|1,0,0]=3 25 B6R0.1 CCOC(=O)NN BB_SC-07159 [2,0,0,0,0,0|2,0,0]=4 26 B6R0.1 CNCC(=O)NC BB_NC-02631 [2,0,0,0,0,0|2,0,0]=4 27 B6R0.1 COC(=O)CC#N BB_SC-06876 [2,0,0,0,0,0|1,0,1]=4 28 B6R0.1 COC(=O)CCBr BB_SC-11223 [2,0,0,0,0,0|1,0,0]=3 29 B6R0.1 COC(=O)CCN BB_NC-01738 [2,0,0,0,0,0|1,0,0]=3 30 B6R0.6 CCCNCCC BB_SC-06961 [2,0,0,0,0,0|2,0,0]=4 31 B6R0.6 CCOCCCN BB_SC-06885 [2,0,0,0,0,0|1,0,1]=4 32 B6R0.3 CCC(Br)C(=O)O BB_SC-09405 [2,0,0,0,0,0|1,0,0]=3 33 B6R0.3 CNC(=O)[C@H](C)N BB_NC-02402 [2,0,0,0,0,0|2,0,0]=4 34 B6R0.3 COC(=O)C(C)=O BB_SC-06762 [2,0,0,0,0,0|1,0,1]=4 35 B6R0.3 COC(=O)[C@H](C)N BB_NC-01234 [2,0,0,0,0,0|1,0,0]=3 36 B6R0.3 C\C=C(/C)C(=O)O BB_NC-02228 [2,0,0,0,0,0|0,0,2]=4 37 B6R0.3 NC(CO)C(=O)O BB_SC-09461 [2,0,0,0,0,0|2,0,0]=4 38 B6R0.3 N[C@@H](CS)C(=O)O BB_NC-02302 [2,0,0,0,0,0|2,0,0]=4 39 B8R0.19 CCC(=O)CC(C)CC BB_SC-06894 [1,1,0,0,0,0|1,0,1]=4 40 B8R0.5 CC(C)OC(=O)CC#N BB_SC-06927 [1,1,0,0,0,0|1,0,1]=4 41 B8R0.5 CCOC(=O)CC(=O)O BB_SC-06245 [1,1,0,0,0,0|1,0,1]=4 42 B8R0.5 CCOC(=O)CC(C)=O BB_SC-07092 [1,1,0,0,0,0|0,0,1]=3 43 B8R0.5 CCOC(=O)C[N+](=O)[O-] BB_SC-06243 [1,1,0,0,0,0|2,0,0]=4 44 B10R0.2 CCCC(=O)CC(=O)OCC BB_SC-11237 [0,1,0,0,0,1|1,0,1]=4 45 B10R0.2 CCOC(=O)CC(=O)OCC BB_SC-07073 [0,1,0,0,0,1|1,0,1]=4 46 B10R0.32 CCOC(=O)C(=O)CC(C)=O BB_SC-03903 [0,2,0,0,0,0|1,0,1]=4 47 B8R1.4 CC1CCCC(=O)C1 BB_SC-06963 [1,0,0,1,0,0|1,0,0]=3 48 B10R1.34 O=C1O[C@H](CO)[C@@H](O)[C@H]1O BB_NC-00562 [0,1,0,1,0,0|2,0,0]=4 49 B10R1.291 CC(=O)C1(C)CCOC1=O BB_NC-02023 [0,1,0,1,0,0|0,0,1]=3 50 B10R1.118 CC1CN(C)C(C)CC1=O BB_SC-02656 [0,1,0,1,0,0|1,0,0]=3 51 B10R2.62 O=C1CN2CCC1CC2 BB_SC-06453 [0,0,0,2,0,0|2,0,0]=4