0 B15R2.2226 N=S(C1=CC=CC=C1)C2=CC=CC=C2 T71229 [0,0,0,0,0,0|2,0,0]=2 1 B15R2.2226 N[C@@H](C1=CC=CC=C1)C2=CC=CN=C2 W10006 [0,0,0,0,0,0|2,0,1]=3 2 B15R2.2226 O=C(C1=CC=NC=C1)C2=NC=CC=C2 C10336 [0,0,0,0,0,0|2,0,0]=2 3 B14R2.6 C1=CC=C(CC2=CC=NC=C2)C=C1 D88648 [1,0,0,0,0,0|1,0,1]=3 4 B14R2.6 C1=CC=C(NC2=NC=CC=N2)C=C1 AC6387 [1,0,0,0,0,0|3,0,0]=4 5 B14R2.6 C1=CC=C([I+]C2=CC=CC=C2)C=C1 D90054 [1,0,0,0,0,0|1,0,0]=2 6 B14R2.6 C1=CC=C([I+]C2=CC=CC=C2)C=C1 T71301 [1,0,0,0,0,0|1,0,0]=2 7 B16R2.120 C=C(C1=CC=CC=C1)C2=CC=C(Br)C=C2 D87301 [0,1,0,0,0,0|1,0,0]=2 8 B16R2.120 CC1=CC=C([C@@H](N)C2=CC=CC=C2)C=C1 N12519 [0,1,0,0,0,0|1,0,1]=3 9 B16R2.120 N[C@@H](C1=CC=CC=C1)C2=CC=C(F)C=C2 N12438 [0,1,0,0,0,0|1,0,1]=3 10 B16R2.187 CN=C(C1=CC=CC=C1)C2=CC=CC=C2 66268 [0,1,0,0,0,0|1,0,0]=2 11 B16R2.187 OCC(C1=CC=CC=C1)C2=CC=CC=C2 96343 [0,1,0,0,0,0|0,0,2]=3 12 B16R2.236 CC1=CC=CC([C@@H](N)C2=CC=CC=C2)=C1 N12520 [0,1,0,0,0,0|1,0,1]=3 13 B16R2.236 CC1=CC=CC([C@@H](N)C2=CC=CC=C2)=C1 Y12733 [0,1,0,0,0,0|1,0,1]=3 14 B16R2.88 NN(CC1=CC=CC=C1)C2=CC=CC=C2 D88762 [0,0,0,0,0,1|2,0,0]=3 15 B16R2.88 O=C(CC1=CC=NC=C1)C2=CC=CC=C2 36531 [0,0,0,0,0,1|1,0,0]=2 16 B16R2.88 O=C(CC1=CN=CC=C1)C2=CC=CC=C2 F52957 [0,0,0,0,0,1|1,0,0]=2 17 B16R2.88 O=C(OC1=CC=CC=C1)C2=CC=NC=C2 D91086 [0,0,0,0,0,1|1,0,0]=2 18 B16R2.88 O=[N+]([N-]C1=CC=CC=C1)C2=CC=CC=C2 D88279 [0,0,0,0,0,1|1,0,0]=2 19 B15R2.29 BrC1=CC=C(CC2=CC=CC=C2)C=C1 D82029 [1,1,0,0,0,0|0,0,1]=3 20 B15R2.29 BrC1=CC=C(NC2=CN=CC=C2)C=C1 AC7375 [1,1,0,0,0,0|2,0,0]=4 21 B15R2.29 CC1=CC=C(SC2=CC=CC=C2)C=C1 D92149 [1,1,0,0,0,0|1,0,0]=3 22 B15R2.29 ClC1=CC=C(CC2=CC=CC=C2)C=C1 F14902 [1,1,0,0,0,0|0,0,1]=3 23 B15R2.29 ClC1=CC=C(CC2=CC=NC=C2)C=C1 D89348 [1,1,0,0,0,0|1,0,1]=4 24 B15R2.29 ClC1=CC=C(CC2=NC=CC=C2)C=C1 D75988 [1,1,0,0,0,0|1,0,1]=4 25 B15R2.29 ClC1=CC=C(OC2=CC=CC=C2)C=C1 C11344 [1,1,0,0,0,0|1,0,0]=3 26 B15R2.29 FC1=CC=C(CC2=CC=CC=C2)C=C1 D90682 [1,1,0,0,0,0|0,0,1]=3 27 B15R2.31 FC1=CC(NC2=CC=CC=C2)=CC=C1 61202 [1,1,0,0,0,0|1,0,0]=3 28 B15R2.31 OC1=CC=CC(OC2=CC=CC=C2)=C1 D72710 [1,1,0,0,0,0|1,0,0]=3 29 B15R2.38 ClC1=C(OC2=CC=CC=C2)C=CC=C1 D87864 [1,1,0,0,0,0|1,0,0]=3 30 B15R2.38 FC1=C(CC2=CC=CC=C2)C=CC=C1 F18180 [1,1,0,0,0,0|0,0,1]=3 31 B17R2.192 CC1=CC=C(C(=O)NC2=CC=CC=C2)C=C1 71023 [0,1,0,0,0,1|0,0,0]=2 32 B17R2.192 C[S@@+](CC1=CC=CC=C1)C2=CC=C(O)C=C2 D89128 [0,1,0,0,0,1|2,0,0]=4 33 B17R2.192 O=C(NC1=CC=CC=C1)C2=CC=C(Cl)C=C2 D85658 [0,1,0,0,0,1|0,0,0]=2 34 B17R2.5273 CC1=CC=CC(C(=O)NC2=CC=CC=C2)=C1 71022 [0,1,0,0,0,1|0,0,0]=2 35 B17R2.5273 NC1=CC=CC(C(=O)NC2=CN=CC=C2)=C1 F21109 [0,1,0,0,0,1|1,0,0]=3 36 B17R2.5293 O=C(NC1=NC(O)=NC=C1)C2=CC=CC=C2 F14842 [0,1,0,0,0,1|2,0,0]=4 37 B17R2.10205 Br[C@@H](C1=CC=CC=C1)[C@H](Br)C2=CC=CC=C2 D89610 [0,1,0,0,0,1|1,0,1]=4 38 B17R2.10205 O=C(C1=CC=CC=C1)[C@H](Cl)C2=CC=CC=C2 D89919 [0,1,0,0,0,1|0,0,0]=2 39 B17R2.203 CC(C)(C1=CC=CC=C1)C2=CC=C(N)C=C2 75921 [0,2,0,0,0,0|1,0,1]=4 40 B17R2.203 NC1=CC=C(S(=O)(=O)C2=CC=CC=C2)C=C1 W17003 [0,2,0,0,0,0|1,0,0]=3 41 B17R2.203 O=S(=O)(C1=CC=CC=C1)C2=CC=C(Cl)C=C2 D89408 [0,2,0,0,0,0|1,0,0]=3 42 B17R2.217 C=C(C1=CC=C(O)C=C1)C2=CC=C(O)C=C2 D90514 [0,2,0,0,0,0|1,0,0]=3 43 B17R2.217 CC1=CC=C(C(=O)C2=CC=C(F)C=C2)C=C1 L10022 [0,2,0,0,0,0|0,0,0]=2 44 B17R2.217 OC(C1=CC=C(Cl)C=C1)C2=CC=C(Cl)C=C2 D89943 [0,2,0,0,0,0|0,0,2]=4 45 B17R2.291 N#C[C@@H](C1=CC=CC=C1)C2=CC=C(Br)C=C2 C15597 [0,2,0,0,0,0|1,0,1]=4 46 B17R2.159 OCCN(C1=CC=CC=C1)C2=CC=CC=C2 S10721 [0,2,0,0,0,0|1,0,1]=4 47 B17R2.2712 CC(C#N)(C1=CC=CC=C1)C2=CC=CC=C2 D90077 [0,2,0,0,0,0|1,0,1]=4 48 B17R2.5711 NC(=S)C(C1=CC=CC=C1)C2=CC=CC=C2 A10507 [0,2,0,0,0,0|0,1,1]=4 49 B17R2.5711 NC(=S)N(C1=CC=CC=C1)C2=CC=CC=C2 D89743 [0,2,0,0,0,0|1,1,0]=4 50 B17R2.20511 CC1=C(C(=O)C2=C(C)C=CC=C2)C=CC=C1 E72655 [0,2,0,0,0,0|0,0,0]=2 51 B15R3.3 C1=CC2=C(C=C1)C3=C(C=CC=C3)[N-]2 D89287 [1,0,0,1,0,0|1,0,0]=3 52 B17R3.8708 C1=CC=C(C2=NC3=C(C=NC=C3)N2)C=C1 L10090 [0,0,0,1,0,1|2,0,0]=4 53 B17R3.8708 C1=CC=C(C2=NC3=NC=CC=C3N2)C=C1 L10088 [0,0,0,1,0,1|2,0,0]=4 54 B17R3.35227 OB1C2=C(C=CC=C2)OC3=C1C=CC=C3 D81228 [0,1,0,1,0,0|1,0,1]=4 55 B13R2.3 C1=CC(C2=CC=NC=C2)=CC=N1 D97812 [1,0,0,0,1,0|2,0,0]=4 56 B13R2.3 C1=CC=C(C2=CN=CN=C2)C=C1 C15637 [1,0,0,0,1,0|2,0,0]=4 57 B13R2.3 C1=CN=C(C2=NC=CC=C2)C=C1 AT26878 [1,0,0,0,1,0|2,0,0]=4 58 B13R2.3 C1=CN=C(C2=NC=CC=C2)C=C1 D89511 [1,0,0,0,1,0|2,0,0]=4 59 B15R2.2195 C1=CC=C(NNC2=CC=CC=C2)C=C1 F15405 [1,0,0,0,0,1|1,0,0]=3 60 B15R2.2195 C1=CC=C(\N=C\C2=CC=CN=C2)C=C1 F21323 [1,0,0,0,0,1|1,0,0]=3 61 B17R2.143 NN(CC1=CC=CC=C1)CC2=CC=CC=C2 D89998 [0,0,0,0,0,2|2,0,0]=4 62 B17R2.143 N\C(=N/C1=CC=CC=C1)NC2=CC=CC=C2 D89841 [0,0,0,0,0,2|1,0,0]=3 63 B17R2.2342 O[C@@H](CCC1=CC=CC=C1)C2=CC=CC=C2 E72716 [0,0,0,0,0,2|0,0,2]=4