0 B11R1.17 BrC1=CC=CC=C1\C=C\C=O BCP04224 [1,0,0,0,0,0|1,0,0]=2 1 B11R1.17 OC1=C(OCCO)C=CC=C1 BCP18969 [1,0,0,0,0,0|1,0,2]=4 2 B11R1.91 [O-][N+](\C=C\C1=CC=CC=C1)=O BCP12490 [1,0,0,0,0,0|1,0,1]=3 3 B13R1.164 O=C(O)CCC1=CC=C(Cl)C=C1Cl BCP17337 [0,1,0,0,0,0|1,0,2]=4 4 B13R1.201 N[C@@H](CC(O)=O)C1=C(Cl)C=CC=C1 BCP10515 [0,1,0,0,0,0|1,0,2]=4 5 B13R1.201 O=C(O)C[C](N)C1=CC=CC=C1F BCP11584 [0,1,0,0,0,0|1,0,2]=4 6 B13R1.3787 CC1=C(OCC(O)=O)C(C)=CC=C1 BCP12802 [0,1,0,0,0,0|2,0,1]=4 7 B13R2.435 CC(C1=NC=2C=CC=CC2S1)=O BCP18676 [0,0,0,1,0,0|2,1,0]=4 8 B13R2.435 OC(C1=CC=2C=CC=CC2N1)=O BCP00082 [0,0,0,1,0,0|1,0,0]=2 9 B13R2.435 OC(C1=CN2C(C=CC=C2)=N1)=O BCP00633 [0,0,0,1,0,0|2,0,0]=3 10 B13R2.5179 OC1=CC=CC=2NC(CCC21)=O BCP13339 [0,0,0,1,0,0|1,0,2]=4 11 B12R1.21 O=C(O)\C=C\C1=CC=C(N)N=C1 BCP19200 [1,1,0,0,0,0|1,0,0]=3 12 B12R1.27 O=C(OCC1=CC=CC=C1)CO BCP10145 [1,1,0,0,0,0|1,0,1]=4 13 B12R1.43 C\C([N+]([O-])=O)=C\C1=CC=CC=C1 BCP10792 [1,1,0,0,0,0|1,0,1]=4 14 B12R1.43 N[C](CC1=CC=CC=C1)C(O)=O BCP16807 [1,1,0,0,0,0|0,0,2]=4 15 B12R1.107 N[C@@H](CC(O)=O)C1=CC=CC=C1 BCP13904 [1,1,0,0,0,0|0,0,2]=4 16 B12R1.107 N[C](c1ccccc1)CC(=O)O BCP12759 [1,1,0,0,0,0|0,0,2]=4 17 B12R1.226 BrC1=CC(CCC(O)=O)=CC=C1 BCP15306 [1,1,0,0,0,0|0,0,2]=4 18 B12R1.226 C1=C(C=CC=C1CCC(O)=O)Cl BCP04483 [1,1,0,0,0,0|0,0,2]=4 19 B12R1.127 BrC1=C(CC(O)=O)C=C(Br)C=C1 BCP11411 [0,1,0,0,1,0|1,0,1]=4 20 B12R1.127 O=C(O)CC1=CC(C)=CC=C1C BCP29307 [0,1,0,0,1,0|1,0,1]=4 21 B12R1.232 OC=1C=C(O)C(=CC1C(O)=O)Br BCP11519 [0,0,1,1,0,0|2,0,0]=4 22 B12R1.56 C1=CC(=C(C=C1C(=O)O)C#N)O BCP28268 [0,0,1,1,0,0|1,0,1]=4 23 B12R1.56 OC1=C(C=O)C=C(C(O)=O)C=C1 BCP05672 [0,0,1,1,0,0|1,0,0]=3 24 B12R2.24 IC1=CC2=C(C=CC=C2)C=C1 BCP13447 [1,0,0,1,0,0|2,0,0]=4 25 B12R2.24 OC1=CC2=CC=CC=C2N=C1 BCP20129 [1,0,0,1,0,0|2,0,0]=4 26 B12R2.1081 FC1=C2C(C=CC=C2)=CC=C1 BCP11223 [1,0,0,1,0,0|2,0,0]=4 27 B14R2.781 O=C(C1=CC2=CC=CC=C2C=N1)O BCP05776 [0,0,0,1,0,1|1,0,0]=3 28 B14R2.781 O=C(C1=CC=C2C=CC=NC2=C1)O BCP10039 [0,0,0,1,0,1|2,0,0]=4 29 B14R2.781 OC([C@@H]1OC2=CC=CC=C2OC1)=O BCP15476 [0,0,0,1,0,1|0,0,2]=4 30 B14R2.8032 O=C(O)C1=CNC2=C1C=CC=C2Cl BCP08387 [0,0,0,1,0,1|1,0,0]=3 31 B14R2.450 C1=CC2=C(C=C1)NC(=C2Br)C(=O)O BCP11466 [0,1,0,1,0,0|1,0,0]=3 32 B14R2.450 O=C(C1=C(N)C2=CC=CC=C2O1)N BCP09362 [0,1,0,1,0,0|1,0,0]=3 33 B14R2.7969 O=C(C1=CC2=C(Cl)C=CC=C2S1)O BCP12371 [0,1,0,1,0,0|0,1,0]=3 34 B14R2.7969 OC(=O)C1=NC2=C(S1)C=CC=C2F BCP00114 [0,1,0,1,0,0|1,1,0]=4 35 B14R2.7969 OC1=CC=CC2=C1OC(C(C)=O)=C2 BCP12670 [0,1,0,1,0,0|1,0,0]=3 36 B14R2.4529 BrC1=CC=C2C=C(C(O)=O)NC2=C1 BCP01428 [0,1,0,1,0,0|1,0,0]=3 37 B14R2.4529 NC1=CC=C2C(C=C(C(O)=O)O2)=C1 BCP01669 [0,1,0,1,0,0|0,0,0]=2 38 B14R2.4529 O=C(C=1NC2=C(C1)C=C(C=C2)Cl)O BCP15099 [0,1,0,1,0,0|1,0,0]=3 39 B14R2.4529 OC(=O)C1=CC2=C(O1)C=CC(O)=C2 BCP18487 [0,1,0,1,0,0|0,0,0]=2 40 B10R1.18 C1=NC=CC=C1CC(O)=O BCP20278 [1,0,0,0,1,0|1,0,1]=4 41 B10R1.18 CC(NC1=CC=CC=C1)=O BCP02363 [1,0,0,0,1,0|2,0,0]=4 42 B10R1.18 NC(CC1=CC=CC=C1)=O BCP10408 [1,0,0,0,1,0|1,0,1]=4 43 B10R1.18 O=C(Cl)OC1=CC=CC=C1 BCP14449 [1,0,0,0,1,0|2,0,0]=4 44 B10R1.18 OC(=O)Cc1ccncc1 BCP05255 [1,0,0,0,1,0|1,0,1]=4 45 B10R1.61 CC(C1=C(O)C=NC=C1)=O BCP28934 [0,0,0,0,2,0|2,0,0]=4 46 B10R1.61 O=C(C1=C(N)C=NC=C1)O BCP09357 [0,0,0,0,2,0|2,0,0]=4 47 B10R1.61 O=C(O)C=1C=NC=CC1Br BCP05403 [0,0,0,0,2,0|2,0,0]=4 48 B10R1.61 OC(=O)c1ccncc1C BCP06101 [0,0,0,0,2,0|2,0,0]=4 49 B10R1.61 OC1=C(C(O)=O)C=CC=C1 BCP09067 [0,0,0,0,2,0|0,0,0]=2