0 B14R2.101 C1=CC=C(COC2=NSC=C2)C=C1 O10878 [0,0,0,0,0,0|3,0,0]=3 1 B14R2.101 C1=CC=C(CON2C=CC=N2)C=C1 D74248 [0,0,0,0,0,0|3,0,0]=3 2 B14R2.101 C1=CC=C(CSC2=CSC=C2)C=C1 AC6748 [0,0,0,0,0,0|3,0,0]=3 3 B14R2.101 C1=CC=C(\C=C\C2=NNN=N2)C=C1 77544 [0,0,0,0,0,0|2,0,2]=4 4 B15R2.64 N[C@@H](CC1=CC=CC=C1)C2=NC=CO2 C73872 [0,1,0,0,0,0|2,0,0]=3 5 B15R2.64 N[C@@H](CC1=CC=CC=C1)C2=NNN=N2 F50830 [0,1,0,0,0,0|2,0,0]=3 6 B15R2.64 O=C(CC1=CC=CC=C1)C2=CC=CO2 N14290 [0,1,0,0,0,0|2,0,1]=4 7 B15R2.100 BrC1=CC=C(CCC2=NC=NN2)C=C1 F51162 [0,1,0,0,0,0|1,0,1]=3 8 B15R2.283 IC1=CN(CCC2=CC=CC=C2)N=C1 D85636 [0,1,0,0,0,0|2,0,0]=3 9 B15R2.283 NC1=CC(CCC2=CC=CC=C2)=NO1 72038 [0,1,0,0,0,0|2,0,0]=3 10 B15R3.1739 C1=CC=C2C(=C1)N=CC3=C2OC=N3 AC5688 [0,0,0,1,0,0|2,0,1]=4 11 B13R2.64 C1=CC=C(CN2C=NN=N2)C=C1 57071 [0,0,0,0,1,0|2,0,1]=4 12 B13R2.64 C1=CC=C(NC2=NC=CS2)C=C1 C15592 [0,0,0,0,1,0|3,0,0]=4 13 B15R2.2195 C1=CC=C(CNC2=CN=CN=C2)C=C1 F18696 [0,0,0,0,0,1|1,0,1]=3 14 B15R2.2195 C1=CC=C(COC2=CN=CC=C2)C=C1 W18609 [0,0,0,0,0,1|2,0,0]=3 15 B15R2.2196 C1=CC=C(CNCC2=COC=C2)C=C1 AC4799 [0,0,0,0,0,1|2,0,0]=3 16 B15R2.2196 C1=CC=C(COCC2=NNN=N2)C=C1 AC4972 [0,0,0,0,0,1|2,0,0]=3 17 B14R2.19 BrC1=NOC(CC2=CC=CC=C2)=N1 FD6015 [0,1,0,0,1,0|1,0,1]=4 18 B14R2.19 NC1=CC(CC2=CC=CC=C2)=NO1 72480 [0,1,0,0,1,0|2,0,0]=4 19 B14R2.19 NC1=CN(CC2=CC=CC=C2)N=C1 F52458 [0,1,0,0,1,0|2,0,0]=4 20 B14R2.19 NC1=NC(CC2=CC=CC=C2)=NN1 AT12246 [0,1,0,0,1,0|1,0,0]=3 21 B14R2.50 BrC1=C(CC2=NNN=N2)C=CC=C1 87056 [0,1,0,0,1,0|2,0,0]=4 22 B14R2.72 BrC1=CC=C(CC2=NC=CN2)C=C1 AC8168 [0,1,0,0,1,0|2,0,0]=4 23 B14R2.72 OC1=CC=C(CC2=NNN=N2)C=C1 D78643 [0,1,0,0,1,0|2,0,0]=4 24 B14R2.114 N[C@H](C1=CC=CC=C1)C2=NNN=N2 F51707 [0,1,0,0,1,0|2,0,0]=4 25 B16R2.71 BrC1=C(SCC2=CC=CC=C2)N=CC=C1 C90996 [0,1,0,0,0,1|2,0,0]=4 26 B16R2.71 ClC1=NC=CC=C1OCC2=CC=CC=C2 AT21000 [0,1,0,0,0,1|2,0,0]=4 27 B16R2.71 NC1=CC=CN=C1OCC2=CC=CC=C2 D87885 [0,1,0,0,0,1|2,0,0]=4 28 B16R2.71 O=C1NC=NC=C1OCC2=CC=CC=C2 D86985 [0,1,0,0,0,1|1,0,0]=3 29 B16R2.71 OC1=C(NCC2=NC=CC=C2)C=CC=C1 C14013 [0,1,0,0,0,1|2,0,0]=4 30 B16R2.71 OC1=CC=CN=C1OCC2=CC=CC=C2 C76947 [0,1,0,0,0,1|2,0,0]=4 31 B16R2.88 N[C@@H](CC1=CC=CN=C1)C2=CC=CC=C2 F50579 [0,1,0,0,0,1|1,0,0]=3 32 B16R2.88 N[C@@H](CC1=CC=NC=C1)C2=CC=CC=C2 F50580 [0,1,0,0,0,1|1,0,1]=4 33 B16R2.88 N[C@@H](CC1=NC=CC=C1)C2=CC=CC=C2 F50577 [0,1,0,0,0,1|1,0,0]=3 34 B16R2.88 O=C(CC1=NC=CC=C1)C2=CC=CC=C2 F50578 [0,1,0,0,0,1|1,0,1]=4 35 B16R2.132 BrC1=CN=C(NCC2=CC=CC=C2)C=C1 W12512 [0,1,0,0,0,1|2,0,0]=4 36 B16R2.132 ClC1=NC=C(SCC2=CC=CC=C2)C=C1 D85746 [0,1,0,0,0,1|2,0,0]=4 37 B16R2.132 FC1=CC=C(CNC2=CN=CC=C2)C=C1 93247 [0,1,0,0,0,1|2,0,0]=4 38 B16R2.132 IC1=NC=C(OCC2=CC=CC=C2)C=C1 96924 [0,1,0,0,0,1|2,0,0]=4 39 B16R2.132 NC1=CC=C(NCC2=NC=CC=C2)C=C1 W17117 [0,1,0,0,0,1|2,0,0]=4 40 B16R2.252 ClC1=CC(OCC2=CC=CC=C2)=NC=C1 O10500 [0,1,0,0,0,1|2,0,0]=4 41 B16R2.252 ClC1=CN=CC(OCC2=CC=CC=C2)=C1 F18259 [0,1,0,0,0,1|2,0,0]=4 42 B16R2.252 ClC1=NC(NCC2=CC=CC=C2)=CC=C1 F15588 [0,1,0,0,0,1|2,0,0]=4 43 B16R2.252 ClC1=NC(NCC2=CC=CC=C2)=NC=C1 O12019 [0,1,0,0,0,1|2,0,0]=4 44 B16R2.252 OC1=CC(CCC2=CC=CC=C2)=CC=C1 26370 [0,1,0,0,0,1|2,0,0]=4 45 B16R2.135 BrC1=CC=C(OCCN2C=CC=N2)C=C1 88343 [0,1,0,0,0,1|2,0,0]=4 46 B14R2.21 O=C1C=CN[C@H](C2=CC=CC=C2)C1 55539 [0,0,1,1,0,0|2,0,0]=4 47 B16R3.3510 NC1=NC2=CC=CC=C2C3=C1N=CN3 D77255 [0,1,0,1,0,0|1,0,1]=4 48 B12R2.2 C1=CC(C2=COC=N2)=CN=C1 O11100 [0,0,0,0,2,0|2,0,0]=4 49 B12R2.2 C1=CC=C(C2=CSC=C2)C=C1 T72133 [0,0,0,0,2,0|2,0,0]=4 50 B12R2.2 C1=CC=C(C2=NON=C2)C=C1 AC2765 [0,0,0,0,2,0|1,0,1]=4 51 B16R2.2256 C1=CN=C(CNCC2=NC=CC=C2)C=C1 W12467 [0,0,0,0,0,2|2,0,0]=4 52 B16R2.2257 C1=CC=C(CNCCC2=CN=CN2)C=C1 AT14791 [0,0,0,0,0,2|0,0,2]=4