0 B14R1.4920 N=C(N)N/N=C/C1=C(C=CC=C1Cl)Cl Z49562666 [0,0,0,0,0,0|0,0,0]=0 1 B14R1.4920 NC(=O)N/N=C/C1=C(C=CC=C1F)F Z49560864 [0,0,0,0,0,0|1,2,0]=3 2 B14R1.4920 NC(=O)NOCC1=C(C=CC=C1F)Cl Z1269166514 [0,0,0,0,0,0|2,1,1]=4 3 B13R1.158 CC1=C(C=CC=C1)/C=N/NC(=N)N Z56859479 [1,0,0,0,0,0|1,0,0]=2 4 B13R1.158 N=C(N)N/N=C/C1=C(C=CC=C1)Br Z204293904 [1,0,0,0,0,0|0,1,0]=2 5 B13R1.158 N=C(N)N/N=C/C1=C(C=CC=C1)Cl Z204610086 [1,0,0,0,0,0|0,0,0]=1 6 B13R1.158 N=C(N)NCCC1=C(C=CC=C1)F Z3034036268 [1,0,0,0,0,0|1,1,1]=4 7 B13R1.158 NC(=O)N/N=C/C1=C(C=CC=C1)Br Z49560875 [1,0,0,0,0,0|1,1,0]=3 8 B13R1.158 NC(=S)N/N=C/C1=C(C=CC=C1)Cl Z49561500 [1,0,0,0,0,0|1,0,0]=2 9 B13R1.158 NC(=S)N/N=C/C1=C(C=CC=C1)O Z49561499 [1,0,0,0,0,0|2,0,0]=3 10 B15R1.8312 NC(=O)COC(=O)C1=C(C=CC=C1Cl)Cl Z18402259 [0,1,0,0,0,0|3,0,0]=4 11 B15R1.42427 CNC(=S)N/N=C/C1=C(C=CC=C1Cl)Cl Z49612588 [0,1,0,0,0,0|1,0,0]=2 12 B15R1.42427 CNC(=S)N/N=C/C1=C(C=CC=C1F)F Z49612614 [0,1,0,0,0,0|1,2,0]=4 13 B15R2.6956 NC1=CC(=NN1)C2=C(C=CC=C2F)F Z317042156 [0,0,0,1,0,0|1,2,0]=4 14 B15R2.6956 NC1=NC(=NN1)C2=C(C=CC=C2F)F Z1259162138 [0,0,0,1,0,0|0,2,0]=3 15 B15R2.6956 NC1=NC(=NO1)C2=C(C=CC=C2F)F Z1813193617 [0,0,0,1,0,0|1,2,0]=4 16 B15R2.6956 NC1=NN=C(O1)C2=C(C=CC=C2F)Cl Z285233718 [0,0,0,1,0,0|1,1,1]=4 17 B15R2.6956 NC1=NN=C(S1)C2=C(C=CC=C2F)Cl Z332385190 [0,0,0,1,0,0|1,1,1]=4 18 B15R2.6956 O=C1NC(=NO1)C2=C(C=CC=C2Cl)Cl Z685625274 [0,0,0,1,0,0|2,0,0]=3 19 B13R1.3787 CC(=O)NCC1=C(C=CC=C1Cl)Cl Z345556840 [0,0,0,0,1,0|2,0,1]=4 20 B13R1.3787 NC(=O)COC1=C(C=CC=C1Cl)Cl Z25063208 [0,0,0,0,1,0|3,0,0]=4 21 B13R1.3787 O=C(O)/C=C/C1=C(C=CC=C1Cl)Cl Z2942852261 [0,0,0,0,1,0|3,0,0]=4 22 B12R1.252 N=C(N)N/N=C/C1=CC=CC=C1 Z56791605 [2,0,0,0,0,0|0,0,0]=2 23 B12R1.252 NC(=O)N/N=C/C1=CN=CC=C1 Z49560577 [2,0,0,0,0,0|2,0,0]=4 24 B12R1.252 NC(=S)N/N=C/C1=CC=CC=C1 Z49561493 [2,0,0,0,0,0|1,0,0]=3 25 B12R1.252 NC(=S)N/N=C/C1=NC=CC=C1 Z49561480 [2,0,0,0,0,0|2,0,0]=4 26 B14R1.154 N=C(N)N/N=C/C1=C(C(=CC=C1)Cl)Cl Z56851458 [1,1,0,0,0,0|0,0,0]=2 27 B14R1.160 C/C(=N\NC(=N)N)/C1=C(C=CC=C1)Cl Z276351674 [1,1,0,0,0,0|0,0,0]=2 28 B14R1.837 CNC(=S)N/N=C/C1=C(C=CC=C1)Cl Z49612344 [1,1,0,0,0,0|1,0,0]=3 29 B14R2.256 CC1=C(C=CC=C1)C2=NNC(=C2)N Z317042210 [1,0,0,1,0,0|2,0,0]=4 30 B14R2.256 NC1=CC(=NN1)C2=C(C=CC=C2)Br Z752370828 [1,0,0,1,0,0|1,1,0]=4 31 B14R2.256 NC1=CC(=NO1)C2=C(C=CC=C2)Cl Z335438996 [1,0,0,1,0,0|2,0,0]=4 32 B14R2.256 NC1=NC(=CO1)C2=C(C=CC=C2)Cl Z939904420 [1,0,0,1,0,0|2,0,0]=4 33 B14R2.256 NC1=NC(=CS1)C2=C(C=CC=C2)Cl Z48847678 [1,0,0,1,0,0|2,0,0]=4 34 B14R2.256 NC1=NC(=NN1)C2=C(C=CC=C2)F Z1211229413 [1,0,0,1,0,0|0,1,0]=3 35 B14R2.256 NC1=NC(=NO1)C2=C(C=CC=C2)Cl Z991477790 [1,0,0,1,0,0|1,0,0]=3 36 B14R2.256 NC1=NC(=NS1)C2=C(C=CC=C2)Cl Z431707848 [1,0,0,1,0,0|1,0,0]=3 37 B14R2.256 NC1=NC(=NS1)C2=C(C=CC=N2)Cl Z1269154018 [1,0,0,1,0,0|2,0,0]=4 38 B14R2.256 NC1=NN=C(N1)C2=C(C=CC=C2)Cl Z1245633261 [1,0,0,1,0,0|0,0,2]=4 39 B14R2.256 NC1=NN=C(S1)C2=C(C=CC=C2)Cl Z332385230 [1,0,0,1,0,0|1,0,1]=4 40 B14R2.256 NC1=NOC(=N1)C2=C(C=CC=C2)Cl Z1147463083 [1,0,0,1,0,0|1,0,1]=4 41 B14R2.256 O=C1CC(=NN1)C2=C(C=CC=C2)Cl Z3222424431 [1,0,0,1,0,0|2,0,0]=4 42 B14R2.256 OC1=NC(=NO1)C2=C(C=CC=C2)Cl Z1245635822 [1,0,0,1,0,0|2,0,0]=4 43 B14R2.256 SC1=NC(=NO1)C2=C(C=CC=C2)Cl Z1065635972 [1,0,0,1,0,0|2,0,0]=4 44 B14R2.9066 FC1=C(C(=CC=C1)Cl)C2=NNN=N2 Z56913124 [1,0,0,1,0,0|1,1,0]=4 45 B16R2.14402 CN1N=C(N=C1N)C2=C(C=CC=C2F)F Z2466333842 [0,1,0,1,0,0|0,2,0]=4 46 B12R1.125 N=C(N)NCC1=C(C=CC=C1)F Z3034959360 [1,0,0,0,1,0|0,1,1]=4 47 B12R1.125 N=C(N)SCC1=C(C=CC=C1)Cl Z48820396 [1,0,0,0,1,0|1,0,1]=4 48 B12R1.125 NC(=O)NCC1=C(C=CC=C1)Cl Z198194806 [1,0,0,0,1,0|1,0,1]=4 49 B12R1.130 CC1=C(SC=C1)/C=N/NC(=N)N Z56856236 [1,0,0,0,1,0|2,0,0]=4 50 B12R1.1009 N=C(N)CC1=C(C=CC=C1Cl)Cl Z1708089988 [0,0,0,0,2,0|0,0,1]=3 51 B12R1.1009 N=C(N)CC1=C(C=CC=C1F)Cl Z1695906722 [0,0,0,0,2,0|0,1,1]=4 52 B12R1.1009 NC(=O)CC1=C(C=CC=C1Cl)Cl Z33546774 [0,0,0,0,2,0|1,0,1]=4 53 B12R1.1009 NC(=O)NC1=C(C=CC=C1Cl)Cl Z1263622729 [0,0,0,0,2,0|1,0,0]=3