0 B18R3.570036 NC1=CC=C2C=C3C=CC(N)=CC3=NC2=C1 D84168 [0,0,0,0,0,0|0,0,0]=0 1 B18R3.570036 NC1=CC=C2C=C3C=CC(N)=CC3=NC2=C1 D89588 [0,0,0,0,0,0|0,0,0]=0 2 B17R3.3205 BrC1=CC2=CC3=CC=CC=C3C=C2C=C1 36004 [1,0,0,0,0,0|2,0,0]=3 3 B17R3.3205 ClC1=CC2=C(C=C1)SC3=C(C=CC=C3)N2 43872 [1,0,0,0,0,0|2,0,1]=4 4 B17R3.3205 ClC1=CC2=CC3=CC=CC=C3C=C2C=C1 T70414 [1,0,0,0,0,0|2,0,0]=3 5 B19R3.2152927 C[N+]1=C2C=C(N)C=CC2=CC3=CC=C(N)C=C31 D88307 [0,1,0,0,0,0|0,0,1]=2 6 B17R2.465 NC1=CC(Cl)=C(OC2=CC=C(Cl)C=C2)C=C1 S10620 [0,0,1,0,0,0|3,0,0]=4 7 B17R3.30284 BrC1=CC2=C(C=C1)C3=C(C=C(Br)C=C3)C2 CX1118 [0,0,0,0,1,0|3,0,0]=4 8 B17R3.30284 BrC1=CC2=C(C=C1)C3=C(C=C(Br)C=C3)N2 50938 [0,0,0,0,1,0|2,0,1]=4 9 B17R3.30284 BrC1=CC2=C(C=C1)C3=C(C=C(I)C=C3)C2 F11670 [0,0,0,0,1,0|3,0,0]=4 10 B17R3.30284 ClC1=CC2=C(C=C1)C3=C(C=C(Cl)C=C3)C2 75392 [0,0,0,0,1,0|3,0,0]=4 11 B17R3.30284 IC1=CC2=C(C=C1)C3=C(C=C(I)C=C3)C2 C15000 [0,0,0,0,1,0|3,0,0]=4 12 B17R3.30284 NC1=CC2=C(C=C1)C3=C(C=C(Br)C=C3)C2 H10919 [0,0,0,0,1,0|2,0,0]=3 13 B17R3.30284 NC1=CC2=C(C=C1)C3=C(C=C(N)C=C3)C2 74254 [0,0,0,0,1,0|1,0,0]=2 14 B17R3.30284 NC1=CC2=C(C=C1)C3=C(C=C(N)C=C3)C2 D89592 [0,0,0,0,1,0|1,0,0]=2 15 B17R3.31627 BrC1=CC2=C(C=C1)NC3=C2C=C(Br)C=C3 FD14043 [0,0,0,0,1,0|3,0,0]=4 16 B17R3.31627 BrC1=CC2=C(C=C1)OC3=C2C=C(Br)C=C3 83184 [0,0,0,0,1,0|3,0,0]=4 17 B17R3.31627 BrC1=CC2=C(C=C1)SC3=C2C=C(Br)C=C3 F17320 [0,0,0,0,1,0|3,0,0]=4 18 B17R3.31627 ClC1=CC2=C(C=C1)NC3=C2C=C(Cl)C=C3 A12642 [0,0,0,0,1,0|3,0,0]=4 19 B17R3.31627 IC1=CC2=C(C=C1)NC3=C2C=C(I)C=C3 32374 [0,0,0,0,1,0|3,0,0]=4 20 B16R2.33 CC1=CC=C(OC2=CC=C(N)C=C2)C=C1 D88366 [1,0,1,0,0,0|2,0,0]=4 21 B16R2.33 NC1=CC=C(NC2=CC=C(N)C=C2)C=C1 D82301 [1,0,1,0,0,0|1,0,0]=3 22 B16R2.33 NC1=CC=C(NC2=CC=C(N)C=C2)C=C1 N11907 [1,0,1,0,0,0|1,0,0]=3 23 B16R2.33 NC1=CC=C(OC2=CC=C(Cl)C=C2)C=C1 75925 [1,0,1,0,0,0|2,0,0]=4 24 B16R2.33 NC1=CC=C(OC2=CC=C(F)C=C2)C=C1 75929 [1,0,1,0,0,0|2,0,0]=4 25 B16R2.33 NC1=CC=C(SC2=CC=C(N)C=C2)C=C1 H11872 [1,0,1,0,0,0|1,0,0]=3 26 B16R3.1720 C1=CC2=C(C=C1)CC3=C(C=CC=C3)C2 D89677 [2,0,0,0,0,0|1,0,1]=4 27 B16R3.1720 C1=CC2=C(C=C1)NC3=C(C=CC=C3)C2 D90359 [2,0,0,0,0,0|0,0,2]=4 28 B16R3.1720 C1=CC2=C(C=C1)OC3=C(C=CC=C3)C2 D70448 [2,0,0,0,0,0|1,0,1]=4 29 B16R3.1720 C1=CC2=C(C=C1)OC3=C(C=CC=C3)N2 F14936 [2,0,0,0,0,0|1,0,1]=4 30 B16R3.1720 C1=CC2=C(C=C1)OC3=C(C=CC=C3)O2 T70685 [2,0,0,0,0,0|2,0,0]=4 31 B16R3.1720 C1=CC2=C(C=C1)SC3=C(C=CC=C3)N2 C16735 [2,0,0,0,0,0|1,0,1]=4 32 B16R3.1720 C1=CC2=C(C=C1)SC3=C(C=CC=C3)O2 RB3009 [2,0,0,0,0,0|2,0,0]=4 33 B16R3.1720 C1=CC2=C(C=C1)SC3=C(C=CC=C3)S2 AC7909 [2,0,0,0,0,0|2,0,0]=4 34 B16R3.1720 C1=CC=C2N=C3C=CC=CC3=CC2=C1 83512 [2,0,0,0,0,0|0,0,0]=2 35 B16R3.1720 C1=CC=C2N=C3C=CC=CC3=CC2=C1 C15113 [2,0,0,0,0,0|0,0,0]=2 36 B16R3.1720 C1=CC=C2N=C3C=CC=CC3=NC2=C1 H11310 [2,0,0,0,0,0|1,0,0]=3 37 B18R3.3608 NC1=CC2=NC3=CC=CC=C3N=C2C=C1O F15563 [1,1,0,0,0,0|1,0,0]=3 38 B18R3.99697 O=C1C2=C(C=CC=C2)OC3=C1C=CC(O)=C3 39423 [1,1,0,0,0,0|2,0,0]=4 39 B20R3.19129637 NC1=CC2=C(C=C1N)OC3=C(C=C(N)C(N)=C3)O2 D94288 [0,2,0,0,0,0|2,0,0]=4 40 B16R3.2583 BrC1=CC2=C(C=C1)NC3=C2C=CC=C3 FD14042 [1,0,0,0,1,0|2,0,0]=4 41 B16R3.2583 BrC1=CC2=C(C=C1)OC3=C2C=CC=C3 74272 [1,0,0,0,1,0|2,0,0]=4 42 B16R3.2583 BrC1=CC2=C(C=C1)SC3=C2C=CC=C3 24689 [1,0,0,0,1,0|2,0,0]=4 43 B16R3.2583 IC1=CC2=C(C=C1)NC3=C2C=CC=C3 FD14045 [1,0,0,0,1,0|2,0,0]=4 44 B16R3.2583 NC1=CC2=C(C=C1)OC3=C2C=CC=C3 W10066 [1,0,0,0,1,0|1,0,0]=3 45 B16R3.2583 OC1=CC2=C(C=C1)OC3=C2C=CC=C3 C10429 [1,0,0,0,1,0|2,0,0]=4 46 B16R3.2637 BrC1=CC2=C(C=C1)C3=C(C=CC=C3)C2 FD14012 [1,0,0,0,1,0|2,0,0]=4 47 B16R3.2637 BrC1=CC2=C(C=C1)C3=C(C=CC=C3)N2 11323 [1,0,0,0,1,0|1,0,1]=4 48 B16R3.2637 BrC1=CC2=C(C=C1)C3=C(C=CC=C3)O2 22936 [1,0,0,0,1,0|2,0,0]=4 49 B16R3.2637 BrC1=CC2=C(C=C1)C3=C(C=CC=C3)S2 F18747 [1,0,0,0,1,0|2,0,0]=4 50 B16R3.2637 ClC1=CC2=C(C=C1)C3=C(C=CC=C3)N2 CS3413 [1,0,0,0,1,0|1,0,1]=4 51 B16R3.2637 IC1=CC2=C(C=C1)C3=C(C=CC=C3)C2 FD14026 [1,0,0,0,1,0|2,0,0]=4 52 B16R3.2637 NC1=CC2=C(C=C1)C3=C(C=CC=C3)C2 D70520 [1,0,0,0,1,0|1,0,0]=3 53 B16R3.2637 NC1=CC2=C(C=C1)C3=C(C=CC=C3)O2 30758 [1,0,0,0,1,0|1,0,0]=3 54 B16R3.2637 OC1=CC2=C(C=C1)C3=C(C=CC=C3)N2 F16106 [1,0,0,0,1,0|1,0,1]=4