0 B10R1.18 CC(=O)Oc1ccccc1 122-79-2 [0,0,0,0,0,0|2,0,0]=2 1 B10R1.18 O=C(O)CC1=CC=CC=C1 103-82-2 [0,0,0,0,0,0|0,0,0]=0 2 B9R1.8 NCCc1ccccc1 64-04-0 [1,0,0,0,0,0|1,0,1]=3 3 B9R1.8 O=CCC1=CC=CC=C1 122-78-1 [1,0,0,0,0,0|0,0,0]=1 4 B11R1.20 O=C(O)Cc1ccc(O)cc1 156-38-7 [0,1,0,0,0,0|0,0,0]=1 5 B11R1.36 O=C(O)C(O)C1=CC=CC=C1 611-71-2 [0,1,0,0,0,0|0,0,0]=1 6 B11R1.36 O=C(O)[C@@H](O)C1=CC=CC=C1 90-64-2 [0,1,0,0,0,0|0,0,0]=1 7 B11R1.86 O=C(O)CC1=CC=CC=C1O 614-75-5 [0,1,0,0,0,0|0,0,0]=1 8 B11R1.157 O=C(O)CC1=CC(O)=CC=C1 621-37-4 [0,1,0,0,0,0|0,0,0]=1 9 B9R1.6 C[C@H](O)c1ccccc1 1445-91-6 [0,0,0,0,1,0|1,0,1]=3 10 B9R1.6 NC(=O)C1=CN=CC=C1 98-92-0 [0,0,0,0,1,0|2,0,0]=3 11 B9R1.6 O=C(O)C1=CC=CC=N1 98-98-6 [0,0,0,0,1,0|1,0,0]=2 12 B9R1.6 O=C(O)c1ccccc1 65-85-0 [0,0,0,0,1,0|0,0,0]=1 13 B9R1.6 O=C(O)c1cccnc1 59-67-6 [0,0,0,0,1,0|1,0,0]=2 14 B11R1.91 O=C(O)CCC1=CC=CC=C1 501-52-0 [0,0,0,0,0,1|0,0,0]=1 15 B11R1.91 O=C(O)\C=C\c1ccccc1 140-10-3 [0,0,0,0,0,1|0,0,1]=2 16 B8R1.2 NCC1=CC=CC=C1 100-46-9 [2,0,0,0,0,0|1,0,0]=3 17 B8R1.2 O=CC1=CC=CC=C1 100-52-7 [2,0,0,0,0,0|0,0,0]=2 18 B8R1.2 OCC1=CC=CC=C1 100-51-6 [2,0,0,0,0,0|0,0,0]=2 19 B10R1.1 NCCc1ccc(O)cc1 51-67-2 [1,1,0,0,0,0|1,0,1]=4 20 B10R1.15 NCC(O)C1=CC=CC=C1 7568-93-6 [1,1,0,0,0,0|1,0,1]=4 21 B10R1.17 O=C\C=C\C1=CC=CC=C1 14371-10-9 [1,1,0,0,0,0|0,0,1]=3 22 B10R1.13 Nc1ccc(C(=O)O)cc1 150-13-0 [0,1,0,0,1,0|0,0,0]=2 23 B10R1.13 O=C(O)C1=CC=C(O)C=C1 99-96-7 [0,1,0,0,1,0|0,0,0]=2 24 B10R1.13 O=C(O)C1=CN=C(O)C=C1 5006-66-6 [0,1,0,0,1,0|1,0,0]=3 25 B10R1.13 O=[N+]([O-])C1=CC=C(O)C=C1 100-02-7 [0,1,0,0,1,0|1,0,1]=4 26 B10R1.61 NC(=O)C1=CC=CC=C1O 65-45-2 [0,1,0,0,1,0|1,0,0]=3 27 B10R1.61 O=C(O)c1ccccc1O 69-72-7 [0,1,0,0,1,0|0,0,0]=2 28 B10R1.113 C[N+]1=CC=CC(C(N)=O)=C1 1005-24-9 [0,1,0,0,1,0|2,0,0]=4 29 B10R1.113 C[n+]1cccc(C(=O)O)c1 6138-41-6 [0,1,0,0,1,0|1,0,0]=3 30 B10R1.113 O=C(O)C1=CC(O)=CC=C1 99-06-9 [0,1,0,0,1,0|0,0,0]=2 31 B12R1.21 O=C(O)CCC1=CC=C(O)C=C1 501-97-3 [0,1,0,0,0,1|0,0,0]=2 32 B12R1.21 O=C(O)\C=C\c1ccc(O)cc1 501-98-4 [0,1,0,0,0,1|0,0,1]=3 33 B12R1.43 N[C@@H](Cc1ccccc1)C(=O)O 63-91-2 [0,1,0,0,0,1|0,0,0]=2 34 B12R1.43 O=C(O)C(=O)CC1=CC=CC=C1 156-06-9 [0,1,0,0,0,1|0,0,0]=2 35 B12R1.43 O=C(O)C(O)CC1=CC=CC=C1 828-01-3 [0,1,0,0,0,1|0,0,0]=2 36 B12R1.43 O=C(O)[C@H](O)CC1=CC=CC=C1 20312-36-1 [0,1,0,0,0,1|0,0,0]=2 37 B12R1.43 [C@H](O)(CC1=CC=CC=C1)C(=O)O 7326-19-4 [0,1,0,0,0,1|0,0,0]=2 38 B12R1.125 O=C(O)CCC1=CC=CC=C1O 495-78-3 [0,1,0,0,0,1|0,0,0]=2 39 B12R1.19 O=C(O)CC1=CC(O)=C(O)C=C1 102-32-9 [0,2,0,0,0,0|0,0,0]=2 40 B12R1.20 N[C@H](C(=O)O)c1ccc(O)cc1 32462-30-9 [0,2,0,0,0,0|0,0,0]=2 41 B12R1.20 O=C(O)C(O)C1=CC=C(O)C=C1 1198-84-1 [0,2,0,0,0,0|0,0,0]=2 42 B12R1.478 CCC(C(=O)O)C1=CC=CC=C1 90-27-7 [0,2,0,0,0,0|0,0,0]=2 43 B12R1.127 O=C(O)CC1=C(O)C=CC(O)=C1 451-13-8 [0,2,0,0,0,0|0,0,0]=2 44 B10R2.7 C1=CC2=C(C=C1)NC=C2 120-72-9 [1,0,0,1,0,0|1,0,1]=4 45 B12R2.18 CC1C(=O)Nc2ccccc21 1504-06-9 [0,1,0,1,0,0|1,0,0]=3 46 B8R1.7 O=C(O)C1=CC=CN1 634-97-9 [0,0,0,0,2,0|1,0,0]=3 47 B8R1.7 O=C(O)C1=COC=C1 488-93-7 [0,0,0,0,2,0|1,0,0]=3