0 B13R2.369 FC1=CC2=C(C=C1Br)C=CN=C2 BCP17529 [0,0,0,0,0,0|4,0,0]=4 1 B13R2.369 NC1=CC=2C=CC=CC2OC1=O BCP20024 [0,0,0,0,0,0|1,0,0]=1 2 B12R2.24 BrC1=CC2=NC=CC=C2C=C1 BCP08383 [1,0,0,0,0,0|3,0,0]=4 3 B12R2.24 ClC1=CC2=CC=CN=C2C=C1 BCP20124 [1,0,0,0,0,0|3,0,0]=4 4 B12R2.24 FC1=CC=C2C=NC=CC2=C1 BCP02781 [1,0,0,0,0,0|3,0,0]=4 5 B12R2.24 IC1=CC2=C(C=CC=C2)C=C1 BCP13447 [1,0,0,0,0,0|2,0,0]=3 6 B12R2.24 NC1=NC2=NC=CC=C2C=C1 BCP04700 [1,0,0,0,0,0|3,0,0]=4 7 B12R2.24 OC1=CC2=CC=CC=C2N=C1 BCP20129 [1,0,0,0,0,0|1,0,0]=2 8 B12R1.43 C\C([N+]([O-])=O)=C\C1=CC=CC=C1 BCP10792 [0,0,1,0,0,0|2,0,1]=4 9 B12R1.43 N[C](CC1=CC=CC=C1)C(O)=O BCP16807 [0,0,1,0,0,0|1,0,2]=4 10 B12R2.18 O=C1NC2=C(C=CC=C2)C1=O BCP15996 [0,0,0,0,1,0|1,0,1]=3 11 B12R2.100 OC1=CC=2C=CNC2C=C1O BCP02562 [0,0,0,0,1,0|2,0,1]=4 12 B11R1.91 [O-][N+](\C=C\C1=CC=CC=C1)=O BCP12490 [1,0,1,0,0,0|1,0,1]=4 13 B11R1.17 BrC1=CC=CC=C1\C=C\C=O BCP04224 [1,0,1,0,0,0|1,0,0]=3 14 B11R2.20 C12=CC=NC=C1C=CC=C2 BCP23537 [2,0,0,0,0,0|2,0,0]=4 15 B13R1.133 O=C(O)\C(S)=C\C1=CC=C(I)C=C1 BCP17762 [0,1,1,0,0,0|0,1,0]=3 16 B13R1.152 O=C(O)[C](O)[C@@H](N)C1=CC=CC=C1 BCP22941 [0,1,1,0,0,0|0,0,2]=4 17 B13R2.57 COC1=CC=2C=NC=CC2C=C1 BCP16502 [1,1,0,0,0,0|2,0,0]=4 18 B13R2.57 ClCC1=NC2=CC=CC=C2C=C1 BCP04093 [1,1,0,0,0,0|2,0,0]=4 19 B13R2.57 NCC1=CN=C2C(C=CC=C2)=C1 BCP11483 [1,1,0,0,0,0|2,0,0]=4 20 B13R2.57 O=Cc1cnc2c(c1)cccc2 BCP15507 [1,1,0,0,0,0|1,0,1]=4 21 B13R2.155 BrC1=CC2=C(C=CC(Br)=C2)C=C1 BCP09880 [1,1,0,0,0,0|2,0,0]=4 22 B13R2.155 O=C1NC2=C(C=CC(O)=C2)C=C1 BCP12809 [1,1,0,0,0,0|1,0,0]=3 23 B13R2.162 CC1=CC=CC2=CC=C(C)N=C21 BCP23522 [1,1,0,0,0,0|2,0,0]=4 24 B13R2.328 BrC1=CC(C)=NC2=C1C=CC=C2 BCP22686 [1,1,0,0,0,0|2,0,0]=4 25 B13R2.328 ClC1=C2C=CC=CC2=NC(Cl)=C1 BCP20135 [1,1,0,0,0,0|2,0,0]=4 26 B13R2.328 NC1=CC(Br)=C2C=CC=CC2=C1 BCP19169 [1,1,0,0,0,0|2,0,0]=4 27 B13R2.328 O=C1C=C(N)NC2=C1C=CC=C2 BCP07687 [1,1,0,0,0,0|2,0,0]=4 28 B13R2.328 OC=1C=2C=CC=CC2SC(C1)=O BCP07314 [1,1,0,0,0,0|0,1,0]=3 29 B13R2.3683 BrC1=CC2=CC=C(Br)C=C2C=C1 BCP11203 [1,1,0,0,0,0|2,0,0]=4 30 B13R2.3683 NC1=CC=C2C=C(Br)C=CC2=C1 BCP14076 [1,1,0,0,0,0|2,0,0]=4 31 B13R2.3683 Nc1ccc2c(c1)ccc(c2)Br BCP10070 [1,1,0,0,0,0|2,0,0]=4 32 B13R2.3028 O=C1C=2C=C(Cl)C=CC2NC1=O BCP06904 [0,1,0,0,1,0|1,0,1]=4 33 B13R2.3028 O=C1NC2=C(C=C(Br)C=C2)C1=O BCP04280 [0,1,0,0,1,0|1,0,1]=4 34 B13R2.3028 O=C1NC2=C(C=C(C)C=C2)C1=O BCP05738 [0,1,0,0,1,0|1,0,1]=4 35 B13R2.4825 O=C1Nc2c(C1=O)cccc2Br BCP09352 [0,1,0,0,1,0|1,0,1]=4 36 B13R2.4856 O=C1C2=C(C=CC=C2C)NC1=O BCP09720 [0,1,0,0,1,0|1,0,1]=4 37 B13R2.435 OC(C1=CC=2C=CC=CC2N1)=O BCP00082 [0,0,1,1,0,0|1,0,0]=3 38 B13R2.435 OC(C1=CN2C(C=CC=C2)=N1)=O BCP00633 [0,0,1,1,0,0|2,0,0]=4 39 B11R1.36 C1=C(C(C(O)=O)C)C=CC=C1 BCP16764 [0,0,1,0,1,0|1,0,1]=4 40 B11R1.36 C=C(C(O)=O)C1=CC=CC=C1 BCP01226 [0,0,1,0,1,0|1,0,0]=3 41 B11R1.36 C[C](c1ccccc1)C(=O)O BCP14307 [0,0,1,0,1,0|1,0,1]=4 42 B11R2.1 C1=C(C2=CC=CC=C2[NH]1)C BCP00912 [1,0,0,0,1,0|2,0,0]=4 43 B11R2.1 O=C1C2=C(CC1)C=CC=C2 BCP19847 [1,0,0,0,1,0|0,0,2]=4 44 B11R2.1 O=C1COc2c1cccc2 BCP07835 [1,0,0,0,1,0|0,0,2]=4 45 B11R2.10 NC1=NC2=CC=CC=C2O1 BCP08019 [1,0,0,0,1,0|2,0,0]=4 46 B11R2.10 O=C1NC=2C=CC=CC2N1 BCP18291 [1,0,0,0,1,0|2,0,0]=4 47 B11R2.10 O=C1OC2=CC=CN=C2N1 BCP10943 [1,0,0,0,1,0|2,0,0]=4 48 B11R2.36 OC1=CN=C2NC=CC2=C1 BCP05680 [1,0,0,0,1,0|2,0,0]=4