0 B14R2.101 C1=CC=C(CCN2C=CN=C2)C=C1 F13151 [0,0,0,0,0,0|3,0,1]=4 1 B14R2.101 C1=CC=C(CSC2=NNN=N2)C=C1 D88976 [0,0,0,0,0,0|4,0,0]=4 2 B15R2.100 CC1=CC=C(NCC2=CC=CS2)C=C1 D95123 [0,1,0,0,0,0|2,0,0]=3 3 B15R2.100 ClC1=CC=C(NCC2=CC=CO2)C=C1 D95129 [0,1,0,0,0,0|2,0,0]=3 4 B13R2.64 C1=CC=C(CC2=NCCN2)C=C1 FD7203 [0,0,0,0,1,0|2,0,1]=4 5 B13R2.64 C1=CC=C(CN2C=CC=C2)C=C1 20631 [0,0,0,0,1,0|3,0,0]=4 6 B13R2.64 C1=CC=C(CN2C=CC=N2)C=C1 33553 [0,0,0,0,1,0|2,0,0]=3 7 B13R2.64 C1=CC=C(CN2C=CN=C2)C=C1 71005 [0,0,0,0,1,0|2,0,1]=4 8 B13R2.64 C1=CC=C(CN2C=CN=N2)C=C1 D83989 [0,0,0,0,1,0|3,0,0]=4 9 B15R2.2195 C1=CC=C(CCC2=CC=CC=C2)C=C1 AC7926 [0,0,0,0,0,1|3,0,0]=4 10 B15R2.2195 C1=CC=C(CNC2=NC=CC=C2)C=C1 D86502 [0,0,0,0,0,1|3,0,0]=4 11 B15R2.2195 C1=CC=C(COC2=CC=CC=C2)C=C1 D94730 [0,0,0,0,0,1|3,0,0]=4 12 B15R2.2195 C1=CC=C(CSC2=CC=CC=C2)C=C1 D88607 [0,0,0,0,0,1|3,0,0]=4 13 B14R2.19 BrC1=CN(CC2=CC=CC=C2)N=C1 53992 [0,1,0,0,1,0|2,0,0]=4 14 B14R2.19 IC1=CN(CC2=CC=CC=C2)N=C1 W12592 [0,1,0,0,1,0|2,0,0]=4 15 B14R2.19 NC1=CN(CC2=CC=CC=C2)N=C1 F30664 [0,1,0,0,1,0|2,0,0]=4 16 B14R2.19 NC1=CN(CC2=CC=CC=C2)N=C1 H11617 [0,1,0,0,1,0|2,0,0]=4 17 B14R2.19 NC1=NC=C(CC2=CC=CC=C2)S1 D97742 [0,1,0,0,1,0|1,0,1]=4 18 B14R2.19 NC1=NNC(CC2=CC=CC=C2)=N1 73819 [0,1,0,0,1,0|1,0,1]=4 19 B14R2.19 S=C1N=C(CC2=CC=CC=C2)CS1 56386 [0,1,0,0,1,0|1,0,1]=4 20 B14R2.72 BrC1=CC=C(CC2=NNN=N2)C=C1 87073 [0,1,0,0,1,0|2,0,0]=4 21 B14R2.72 BrC1=CC=C(CN2C=NC=N2)C=C1 72097 [0,1,0,0,1,0|1,0,1]=4 22 B14R2.72 NC1=CC=C(CN2C=CC=N2)C=C1 C77898 [0,1,0,0,1,0|2,0,0]=4 23 B14R2.72 NC1=CC=C(CN2C=NC=N2)C=C1 40106 [0,1,0,0,1,0|1,0,1]=4 24 B14R2.114 O=C(C1=CC=CC=C1)C2=CNC=C2 D84176 [0,1,0,0,1,0|1,0,1]=4 25 B16R2.71 NC1=C(NCC2=CC=CC=C2)C=CC=C1 Y10422 [0,1,0,0,0,1|2,0,0]=4 26 B16R2.88 NN(CC1=CC=CC=C1)C2=CC=CC=C2 D88647 [0,1,0,0,0,1|2,0,0]=4 27 B16R2.88 O=C(NC1=CC=CC=C1)C2=CN=CC=C2 F12013 [0,1,0,0,0,1|1,0,1]=4 28 B16R2.88 O=C(NC1=CC=CC=C1)C2=CN=CC=C2 T72833 [0,1,0,0,0,1|1,0,1]=4 29 B16R2.88 O=C(NC1=CC=CC=C1)C2=NC=CC=C2 W12751 [0,1,0,0,0,1|1,0,1]=4 30 B16R2.88 O[C@@H](CC1=NC=CN=C1)C2=CC=CC=C2 D94962 [0,1,0,0,0,1|1,0,1]=4 31 B16R2.252 BrC1=CC(NCC2=CC=CC=C2)=CC=C1 31790 [0,1,0,0,0,1|2,0,0]=4 32 B16R2.5767 O=C(NCC1=CC=CO1)C2=CC=CC=C2 D93663 [0,1,0,0,0,1|2,0,0]=4 33 B16R2.1063 CC1=C(C)C=C(NCC2=CC=CO2)C=C1 D95124 [0,2,0,0,0,0|2,0,0]=4 34 B16R2.3000 CC1=C(NCC2=CC=CO2)C=CC(F)=C1 D95130 [0,2,0,0,0,0|2,0,0]=4 35 B16R2.1973 C#CC1=CC=CC(NCC2=CC=CS2)=C1 D95140 [0,2,0,0,0,0|2,0,0]=4 36 B14R2.6 C1=CC=C(NC2=NC=CC=C2)C=C1 28911 [0,0,1,1,0,0|1,0,1]=4 37 B16R3.5925 C1=CC2=C(C=C1)NC(C3=CSC=N3)=N2 E70385 [0,1,0,1,0,0|1,0,1]=4 38 B12R2.2 C1=CC=C(C2=CC=CS2)C=C1 65572 [0,0,0,0,2,0|2,0,0]=4 39 B12R2.2 C1=CC=C(C2=CN=CO2)C=C1 BL004766 [0,0,0,0,2,0|1,0,1]=4 40 B12R2.2 C1=CC=C(C2=CNC=N2)C=C1 78068 [0,0,0,0,2,0|0,0,0]=2 41 B12R2.2 C1=CC=C(C2=CNN=N2)C=C1 53758 [0,0,0,0,2,0|1,0,0]=3 42 B12R2.2 C1=CC=C(C2=NC=CN2)C=C1 F11700 [0,0,0,0,2,0|2,0,0]=4 43 B12R2.2 C1=CC=C(C2=NC=CS2)C=C1 70924 [0,0,0,0,2,0|2,0,0]=4 44 B12R2.2 C1=CC=C(C2=NNC=C2)C=C1 CL3440 [0,0,0,0,2,0|2,0,0]=4 45 B12R2.2 C1=CC=C(N2C=CC=N2)C=C1 39296 [0,0,0,0,2,0|2,0,0]=4 46 B12R2.2 C1=CC=C(N2C=NC=N2)C=C1 Y10504 [0,0,0,0,2,0|1,0,1]=4 47 B12R2.2 C1=CN=C(C2=NNC=N2)C=C1 22951 [0,0,0,0,2,0|2,0,0]=4 48 B16R2.2256 C1=CC=C(CCCC2=NC=CC=C2)C=C1 D92110 [0,0,0,0,0,2|2,0,0]=4 49 B16R2.2256 C1=CC=C(CNCC2=CC=CC=C2)C=C1 D77870 [0,0,0,0,0,2|2,0,0]=4 50 B16R2.2256 C1=CC=C(CNCC2=CC=CN=C2)C=C1 77370 [0,0,0,0,0,2|1,0,0]=3 51 B16R2.2256 C1=CN=C(CNCC2=NC=CC=C2)C=C1 53208 [0,0,0,0,0,2|2,0,0]=4