0 B10R1.15 CC(NN)c1ccccc1 T33268 [1,0,0,0,0,0|2,0,0]=3 1 B10R1.15 CNC(=O)c1ccccc1 T12150 [1,0,0,0,0,0|1,0,2]=4 2 B10R1.15 COC(=O)c1cccnc1 T5562 [1,0,0,0,0,0|1,0,2]=4 3 B10R1.15 COC(c1ncccc1)=O T22220 [1,0,0,0,0,0|1,0,2]=4 4 B10R1.15 N#C[C@@H](c1ccccc1)O T9158 [1,0,0,0,0,0|2,0,0]=3 5 B10R1.15 NCC(O)c1ccccc1 T4873 [1,0,0,0,0,0|2,0,0]=3 6 B10R1.15 OC(C=C)c1ccccc1 T50007 [1,0,0,0,0,0|1,0,1]=3 7 B10R1.15 OCC(O)c1ccccc1 T1346 [1,0,0,0,0,0|2,0,0]=3 8 B12R1.478 CCC(C(O)=O)c1ccccc1 T0631 [0,1,0,0,0,0|3,0,0]=4 9 B9R1.6 CC(=O)c1ccccc1 T7446 [2,0,0,0,0,0|0,0,2]=4 10 B9R1.6 C[C@H](O)c1ccccc1 T4784 [2,0,0,0,0,0|0,0,0]=2 11 B9R1.6 OB(O)c1ccccc1 T30355 [2,0,0,0,0,0|1,0,0]=3 12 B9R1.6 OC(=O)c1ccccc1 T0833 [2,0,0,0,0,0|0,0,2]=4 13 B9R1.6 OP(=O)c1ccccc1 T20416 [2,0,0,0,0,0|1,0,1]=4 14 B9R1.8 CCOc1ccccc1 T19753 [2,0,0,0,0,0|2,0,0]=4 15 B9R1.8 CNCc1ccccc1 T8016 [2,0,0,0,0,0|1,0,0]=3 16 B9R1.8 NCCc1ccccc1 T2935 [2,0,0,0,0,0|2,0,0]=4 17 B9R1.8 NCCc1ccccc1 T7433 [2,0,0,0,0,0|2,0,0]=4 18 B9R1.8 O=CCc1ccccc1 TCS1857 [2,0,0,0,0,0|2,0,0]=4 19 B9R1.8 OCCc1ccccc1 T0011 [2,0,0,0,0,0|2,0,0]=4 20 B11R1.16 CC(/C=N/O)c1ccccc1 T29369 [1,1,0,0,0,0|2,0,0]=4 21 B11R1.16 CC(N=C=S)c1ccccc1 T27188 [1,1,0,0,0,0|1,0,1]=4 22 B11R1.16 CCOC(=O)c1ccccc1 TN4020 [1,1,0,0,0,0|0,0,2]=4 23 B11R1.16 C[C@@H](C1=CC=CC=C1)N=C=S T27793 [1,1,0,0,0,0|1,0,1]=4 24 B11R1.16 C[C@H](C1=CC=CC=C1)N=C=S T19758 [1,1,0,0,0,0|1,0,1]=4 25 B11R1.22 CCC(C)c1ccc(O)cc1 T12515 [1,1,0,0,0,0|1,0,0]=3 26 B11R1.22 COC(=O)c1ccc(O)cc1 T3728 [1,1,0,0,0,0|0,0,2]=4 27 B11R1.22 NCC(O)c1ccc(O)cc1 T0469 [1,1,0,0,0,0|2,0,0]=4 28 B11R1.23 COC(=O)c1cccc(O)c1 T33331 [1,1,0,0,0,0|0,0,2]=4 29 B11R1.23 OC(C#N)c1cccc(O)c1 T33176 [1,1,0,0,0,0|2,0,0]=4 30 B11R1.36 C[C@H](O)[C@H](O)c1ccccc1 TN4002 [1,1,0,0,0,0|1,0,0]=3 31 B11R1.36 OC(C(O)=O)c1ccccc1 T33320 [1,1,0,0,0,0|2,0,0]=4 32 B11R1.36 OC(C(O)=O)c1ccccc1 T4848 [1,1,0,0,0,0|2,0,0]=4 33 B11R1.36 OC(C([O-])=O)c1ccccc1 T30005 [1,1,0,0,0,0|2,0,0]=4 34 B11R1.36 O[C@@H](C(O)=O)c1ccccc1 T2S0122 [1,1,0,0,0,0|2,0,0]=4 35 B11R1.222 COC(=O)c1ccccc1N TN1925 [1,1,0,0,0,0|0,0,2]=4 36 B11R1.222 COC(=O)c1ccccc1O T0399 [1,1,0,0,0,0|0,0,2]=4 37 B13R1.331 COC(CO)c1ccc(O)c(O)c1 TN3001 [0,2,0,0,0,0|2,0,0]=4 38 B13R1.412 COC(OC)(OC)c1ccccc1 T20368 [0,2,0,0,0,0|0,0,0]=2 39 B11R2.4 N[C@@H]1C[C@H]1c2ccccc2 T1025 [1,0,0,1,0,0|2,0,0]=4 40 B11R2.4 N[C@@H]1C[C@H]1c2ccccc2 T7942 [1,0,0,1,0,0|2,0,0]=4 41 B13R2.13 Oc1cccc(c1)C2SCCS2 T33990 [0,1,0,1,0,0|0,2,0]=4 42 B11R1.40 CC(Cc1ccccc1)NN T24631 [1,0,0,0,0,1|2,0,0]=4