0 B12R2.246 Brc1cc(Br)c2ccsc2n1 Amb22751179 [0,0,0,0,0,0|4,0,0]=4 1 B12R2.246 Brc1cc(Br)c2ocnc2c1 Amb17305262 [0,0,0,0,0,0|4,0,0]=4 2 B12R2.246 Brc1cc(Br)c2scnc2c1 Amb24329629 [0,0,0,0,0,0|4,0,0]=4 3 B12R2.246 Brc1cc(I)c2ocnc2c1 Amb24088430 [0,0,0,0,0,0|4,0,0]=4 4 B12R2.246 Brc1nc(Br)c2scnc2n1 Amb27230624 [0,0,0,0,0,0|2,0,1]=3 5 B12R2.246 CC1=C2N=CN=C2NC(=S)N1 Amb25238401 [0,0,0,0,0,0|2,0,2]=4 6 B12R2.246 CC1=Cc2nccn2C(=O)N1 Amb22753427 [0,0,0,0,0,0|4,0,0]=4 7 B12R2.246 CC1=Cc2sccc2C(=O)N1 Amb24484813 [0,0,0,0,0,0|4,0,0]=4 8 B12R2.246 CC1=Cn2nccc2C(=O)N1 Amb33016839 [0,0,0,0,0,0|4,0,0]=4 9 B12R2.246 CC1=NC(=O)C2=CC=NC2=C1 Amb28285429 [0,0,0,0,0,0|3,0,1]=4 10 B12R2.246 CC1=NC(=O)N2NC=CC2=N1 Amb26400299 [0,0,0,0,0,0|3,0,1]=4 11 B12R2.246 CC1=NC2=C(CNC2)C(=O)N1 Amb19516817 [0,0,0,0,0,0|4,0,0]=4 12 B12R2.246 CC1=NC2=C(CNC2)C(=O)N1 Amb22899540 [0,0,0,0,0,0|4,0,0]=4 13 B12R2.246 CC1=Nc2ccnn2C(=O)N1 Amb23439380 [0,0,0,0,0,0|3,0,1]=4 14 B12R2.246 CC1=Nc2ccsc2C(=O)N1 Amb19515850 [0,0,0,0,0,0|3,0,0]=3 15 B12R2.246 CC1=Nc2occc2C(=O)N1 Amb27646757 [0,0,0,0,0,0|3,0,0]=3 16 B12R2.246 CC1=Nc2oncc2C(=O)N1 Amb18791470 [0,0,0,0,0,0|4,0,0]=4 17 B12R2.246 CC1=Nc2sccc2C(=O)N1 Amb19516704 [0,0,0,0,0,0|3,0,0]=3 18 B12R2.246 CC1=Nc2sccc2C(=O)N1 Amb22492358 [0,0,0,0,0,0|3,0,0]=3 19 B12R2.246 CC1=Nc2sccc2C(=S)N1 Amb18012495 [0,0,0,0,0,0|3,1,0]=4 20 B12R2.246 Cc1cc(Br)cc2ncoc12 Amb17571385 [0,0,0,0,0,0|4,0,0]=4 21 B12R2.246 Cc1cc(Br)cc2ncsc12 Amb24527957 [0,0,0,0,0,0|4,0,0]=4 22 B12R2.246 Cc1cc(Br)nc2ccsc12 Amb35690161 [0,0,0,0,0,0|4,0,0]=4 23 B12R2.246 Clc1cc(Br)cc2ncoc12 Amb17305043 [0,0,0,0,0,0|4,0,0]=4 24 B12R2.246 Clc1nc(Cl)c2scnc2n1 Amb21964347 [0,0,0,0,0,0|2,1,1]=4 25 B12R2.246 Fc1cc(Br)cc2ncoc12 Amb17571469 [0,0,0,0,0,0|4,0,0]=4 26 B12R2.246 NC1=C2C=CN=C2NC(=O)N1 Amb22169766 [0,0,0,0,0,0|3,0,1]=4 27 B12R2.246 NC1=C2NC=CC2=NC(=S)N1 Amb28461335 [0,0,0,0,0,0|3,0,0]=3 28 B12R2.246 NC1=C2NC=NC2=NC(=O)N1 Amb22002021 [0,0,0,0,0,0|2,0,0]=2 29 B12R2.246 NC1=CC(=O)N=C2N=CNN12 Amb22491264 [0,0,0,0,0,0|4,0,0]=4 30 B12R2.246 NC1=Cc2ncnn2C(=O)N1 Amb18201792 [0,0,0,0,0,0|3,0,1]=4 31 B12R2.246 NC1=NC(=O)C2=NC=NC2=N1 Amb26874999 [0,0,0,0,0,0|1,0,2]=3 32 B12R2.246 NC1=NC2=C(CCC2)C(=O)N1 Amb18943761 [0,0,0,0,0,0|3,0,1]=4 33 B12R2.246 NC1=NC2=C(CNC2)C(=O)N1 Amb18201390 [0,0,0,0,0,0|4,0,0]=4 34 B12R2.246 NC1=NC2=C(N=CC2)C(=O)N1 Amb25061356 [0,0,0,0,0,0|2,0,1]=3 35 B12R2.246 NC1=NC2=NCN=C2C(=O)N1 Amb26884913 [0,0,0,0,0,0|1,0,2]=3 36 B12R2.246 NC1=Nc2ccnn2C(=O)N1 Amb25806206 [0,0,0,0,0,0|3,0,1]=4 37 B12R2.246 NC1=Nc2ccsc2C(=O)N1 Amb18199505 [0,0,0,0,0,0|3,0,0]=3 38 B12R2.246 NC1=Nc2occc2C(=O)N1 Amb18201810 [0,0,0,0,0,0|3,0,0]=3 39 B12R2.246 NC1=Nc2oncc2C(=O)N1 Amb18201484 [0,0,0,0,0,0|4,0,0]=4 40 B12R2.246 NC1=Nc2sccc2C(=O)N1 Amb18537423 [0,0,0,0,0,0|3,0,0]=3 41 B12R2.246 NC1=Nc2scnc2C(=S)N1 Amb27983752 [0,0,0,0,0,0|2,1,1]=4 42 B12R2.246 NC1N=C2N=CN=C2C(=O)N1 Amb22015182 [0,0,0,0,0,0|1,0,2]=3 43 B12R2.246 NC1N=C2N=CN=C2C(=S)N1 Amb22002019 [0,0,0,0,0,0|1,1,2]=4 44 B12R2.246 Nc1cc(Br)cc2ncoc12 Amb17305002 [0,0,0,0,0,0|4,0,0]=4 45 B12R2.246 Nc1nc(=S)nc2nccc12 Amb16233428 [0,0,0,0,0,0|3,0,1]=4 46 B12R2.246 O=C1C=C(Cl)N=C2C=CNN12 Amb22753447 [0,0,0,0,0,0|3,1,0]=4 47 B12R2.246 O=C1C=C2N=CNN2C(=O)N1 Amb27597494 [0,0,0,0,0,0|3,0,0]=3 48 B12R2.246 O=C1Cc2ncsc2C(=O)N1 Amb28388364 [0,0,0,0,0,0|3,0,0]=3 49 B12R2.246 O=C1Cc2occc2C(=O)N1 Amb26635509 [0,0,0,0,0,0|4,0,0]=4 50 B12R2.246 O=C1Cc2sccc2C(=O)N1 Amb28075708 [0,0,0,0,0,0|4,0,0]=4 51 B12R2.246 O=C1N=C(Br)N=C2NC=NC12 Amb24484826 [0,0,0,0,0,0|0,0,4]=4 52 B12R2.246 O=C1N=C(Cl)N=C2C=CN=C12 Amb27176778 [0,0,0,0,0,0|1,1,2]=4 53 B12R2.246 O=C1N=C2N=CN=C2C(=O)N1 Amb26457596 [0,0,0,0,0,0|1,0,1]=2 54 B12R2.246 O=C1N=C2N=CN=C2C(=S)N1 Amb24759076 [0,0,0,0,0,0|1,1,1]=3 55 B12R2.246 O=C1N=C2NNC=C2C(=O)N1 Amb22494134 [0,0,0,0,0,0|3,0,1]=4 56 B12R2.246 O=C1N=C2NNNC2C(=O)N1 Amb22002017 [0,0,0,0,0,0|2,0,2]=4 57 B12R2.246 O=C1NC(=O)C2=C(N=CC2)N1 Amb27230115 [0,0,0,0,0,0|2,0,1]=3 58 B12R2.246 O=C1NC(=O)c2ccsc2N1 Amb22411480 [0,0,0,0,0,0|3,0,1]=4 59 B12R2.246 O=C1NC(=O)c2sccc2N1 Amb18548684 [0,0,0,0,0,0|3,0,1]=4 60 B12R2.246 O=C1NC(=O)n2ncnc2N1 Amb26849061 [0,0,0,0,0,0|2,0,2]=4 61 B12R2.246 O=C1NC(=S)N=C2N=CN=C12 Amb16232218 [0,0,0,0,0,0|1,0,1]=2 62 B12R2.246 O=C1NC(=S)Nc2ccoc21 Amb35825558 [0,0,0,0,0,0|3,0,1]=4 63 B12R2.246 O=C1NC(=S)Nc2ccsc21 Amb19852860 [0,0,0,0,0,0|3,0,1]=4 64 B12R2.246 O=C1NC(=S)Nc2sccc21 Amb20241860 [0,0,0,0,0,0|3,0,1]=4 65 B12R2.246 O=C1NC(Br)=Cc2ccnn21 Amb18770547 [0,0,0,0,0,0|3,0,1]=4 66 B12R2.246 O=C1NC(Br)=Cc2ncnn21 Amb18770933 [0,0,0,0,0,0|2,0,1]=3 67 B12R2.246 O=C1NC(Cl)=Cc2nccn21 Amb22753446 [0,0,0,0,0,0|3,1,0]=4 68 B12R2.246 O=C1NC(Cl)=Cc2sccc21 Amb27613191 [0,0,0,0,0,0|3,1,0]=4 69 B12R2.246 O=C1NC(Cl)=Nc2ccsc21 Amb23412156 [0,0,0,0,0,0|2,1,0]=3 70 B12R2.246 O=C1NC(Cl)=Nc2sccc21 Amb23412157 [0,0,0,0,0,0|2,1,0]=3 71 B12R2.246 O=C1NC(Cl)N=C2N=CN=C12 Amb22015191 [0,0,0,0,0,0|0,1,2]=3 72 B12R2.246 O=C1NC(O)=Nc2ccsc21 Amb19886901 [0,0,0,0,0,0|3,0,0]=3 73 B12R2.246 O=C1NC(S)=NC2=C1CCC2 Amb18012717 [0,0,0,0,0,0|3,0,1]=4 74 B12R2.246 O=C1NC(S)=Nc2ccsc21 Amb18328476 [0,0,0,0,0,0|3,0,0]=3 75 B12R2.246 O=C1NC(S)=Nc2sccc21 Amb18028660 [0,0,0,0,0,0|3,0,0]=3 76 B12R2.246 O=C1NC2=NC=NC2=C(F)N1 Amb27839797 [0,0,0,0,0,0|2,0,2]=4 77 B12R2.246 O=c1nc([S-])nc2nncc12 Amb1971544 [0,0,0,0,0,0|3,0,1]=4 78 B12R2.246 Oc1nc(O)c2scnc2n1 Amb21964358 [0,0,0,0,0,0|2,0,2]=4 79 B12R2.246 S=C1N=C2N=CN=C2C(=S)N1 Amb17942881 [0,0,0,0,0,0|1,1,1]=3 80 B11R2.36 Brc1ccc2c(n1)CCN2 Amb24081392 [1,0,0,0,0,0|2,0,1]=4 81 B11R2.36 Brc1ccc2ccoc2n1 Amb23437182 [1,0,0,0,0,0|3,0,0]=4 82 B11R2.36 Brc1ccc2occc2n1 Amb18187816 [1,0,0,0,0,0|3,0,0]=4 83 B11R2.36 Brc1ccc2ocnc2c1 Amb3941364 [1,0,0,0,0,0|3,0,0]=4 84 B11R2.36 Brc1ccc2ocnc2n1 Amb25782928 [1,0,0,0,0,0|2,0,0]=3 85 B11R2.36 Brc1ccc2sccc2n1 Amb18769649 [1,0,0,0,0,0|3,0,0]=4 86 B11R2.36 Brc1ccc2scnc2c1 Amb13890379 [1,0,0,0,0,0|3,0,0]=4 87 B11R2.36 Brc1ccn2ccnc2n1 Amb18810519 [1,0,0,0,0,0|3,0,0]=4 88 B11R2.36 Brc1ccn2ncnc2n1 Amb33994489 [1,0,0,0,0,0|2,0,1]=4 89 B11R2.36 Brc1ncc2scnc2n1 Amb18770619 [1,0,0,0,0,0|1,0,1]=3 90 B11R2.36 Cc1ccc2ocnc2n1 Amb27641147 [1,0,0,0,0,0|3,0,0]=4 91 B11R2.36 Clc1ccc2ocnc2n1 Amb27958509 [1,0,0,0,0,0|2,1,0]=4 92 B11R2.36 Nc1ccc2ocnc2n1 Amb27812068 [1,0,0,0,0,0|3,0,0]=4 93 B11R2.36 O=C1N=C2N=CNC2=CN1 Amb25086870 [1,0,0,0,0,0|1,0,0]=2 94 B11R2.36 O=C1N=C2OC=CC2=CN1 Amb24366228 [1,0,0,0,0,0|3,0,0]=4 95 B11R2.36 O=C1N=CC2=CC=NC2=N1 Amb22002012 [1,0,0,0,0,0|2,0,1]=4 96 B11R2.36 S=C1NC=C2C=CN=C2N1 Amb27428569 [1,0,0,0,0,0|2,0,1]=4 97 B11R2.106 Brc1ccnc2ncoc12 Amb22723444 [1,0,0,0,0,0|3,0,0]=4 98 B11R2.106 Brc1ncnc2ncsc12 Amb18770629 [1,0,0,0,0,0|2,0,1]=4 99 B11R2.106 Clc1ccnc2ncoc12 Amb27958531 [1,0,0,0,0,0|3,0,0]=4 100 B11R2.106 Clc1ncnc2c1CC=N2 Amb27960916 [1,0,0,0,0,0|2,0,1]=4 101 B11R2.106 Clc1ncnc2ncsc12 Amb22735978 [1,0,0,0,0,0|2,0,1]=4 102 B11R2.106 O=C1C=CN=C2N=CNN12 Amb26959404 [1,0,0,0,0,0|2,0,0]=3 103 B11R2.106 O=C1N=CN=C2N=NC=C12 Amb27843585 [1,0,0,0,0,0|2,0,1]=4 104 B11R2.106 O=C1N=CN=C2N=NN=C12 Amb28056851 [1,0,0,0,0,0|1,0,2]=4 105 B11R2.106 O=C1N=NN=C2N=CN=C12 Amb25889975 [1,0,0,0,0,0|1,0,2]=4 106 B11R2.106 O=C1NC=CC2=NC=CC12 Amb27668194 [1,0,0,0,0,0|2,0,1]=4 107 B11R2.106 O=C1NC=Cc2ccoc21 Amb21927943 [1,0,0,0,0,0|3,0,0]=4 108 B11R2.106 O=C1NC=Cc2ccsc21 Amb22235448 [1,0,0,0,0,0|3,0,0]=4 109 B11R2.106 O=C1NC=Cc2nccn21 Amb22352382 [1,0,0,0,0,0|3,0,0]=4 110 B11R2.106 O=C1NC=Cc2ncnn21 Amb21928082 [1,0,0,0,0,0|2,0,1]=4 111 B11R2.106 O=C1NC=Cc2nnsc21 Amb24119412 [1,0,0,0,0,0|3,0,0]=4 112 B11R2.106 O=C1NC=Cc2occc21 Amb19267112 [1,0,0,0,0,0|3,0,0]=4 113 B11R2.106 O=C1NC=Cn2nccc21 Amb22435243 [1,0,0,0,0,0|3,0,0]=4 114 B11R2.106 O=C1NC=NC2=C1CN=N2 Amb24079502 [1,0,0,0,0,0|2,0,0]=3 115 B11R2.106 O=C1NC=NC2=C1COC2 Amb25675730 [1,0,0,0,0,0|3,0,0]=4 116 B11R2.106 O=C1NC=NC2=C1SCC2 Amb27425098 [1,0,0,0,0,0|2,0,1]=4 117 B11R2.106 O=C1NC=NC2=NONC12 Amb25915754 [1,0,0,0,0,0|1,0,1]=3 118 B11R2.106 O=C1NC=NC2C=CN=C12 Amb27851783 [1,0,0,0,0,0|1,0,2]=4 119 B11R2.106 O=C1NC=Nc2ccnn21 Amb21855865 [1,0,0,0,0,0|2,0,1]=4 120 B11R2.106 O=C1NC=Nc2ccoc21 Amb22234742 [1,0,0,0,0,0|2,0,0]=3 121 B11R2.106 O=C1NC=Nc2ccsc21 Amb18537410 [1,0,0,0,0,0|2,0,0]=3 122 B11R2.106 O=C1NC=Nc2nccn21 Amb27185961 [1,0,0,0,0,0|2,0,0]=3 123 B11R2.106 O=C1NC=Nc2ncnn21 Amb22032558 [1,0,0,0,0,0|1,0,1]=3 124 B11R2.106 O=C1NC=Nc2nonc21 Amb27856085 [1,0,0,0,0,0|1,0,1]=3 125 B11R2.106 O=C1NC=Nc2nsnc21 Amb25248843 [1,0,0,0,0,0|1,0,1]=3 126 B11R2.106 O=C1NC=Nc2occc21 Amb22371686 [1,0,0,0,0,0|2,0,0]=3 127 B11R2.106 O=C1NC=Nc2sccc21 Amb18031834 [1,0,0,0,0,0|2,0,0]=3 128 B11R2.106 O=C1NC=Nc2sncc21 Amb25887991 [1,0,0,0,0,0|3,0,0]=4 129 B11R2.106 O=C1NC=Nc2snnc21 Amb21864212 [1,0,0,0,0,0|2,0,1]=4 130 B11R2.106 O=C1NC=Nn2cccc21 Amb21856772 [1,0,0,0,0,0|3,0,0]=4 131 B11R2.106 O=C1NC=Nn2ccnc21 Amb23440171 [1,0,0,0,0,0|2,0,1]=4 132 B11R2.106 O=C1NCN=C2N=CN=C12 Amb22001421 [1,0,0,0,0,0|0,0,2]=3 133 B11R2.106 O=C1NN=Cc2ncsc21 Amb32685640 [1,0,0,0,0,0|3,0,0]=4 134 B11R2.106 O=C1NNC=C2N=CC=C12 Amb27982183 [1,0,0,0,0,0|3,0,0]=4 135 B11R2.106 O=C1NNN=C2N=CN=C12 Amb27150971 [1,0,0,0,0,0|1,0,1]=3 136 B11R2.106 O=c1nccc2ncnc12 Amb4010214 [1,0,0,0,0,0|1,0,2]=4 137 B11R2.106 S=C1N=CN=C2N=CC=C12 Amb27443636 [1,0,0,0,0,0|1,1,1]=4 138 B11R2.106 S=C1NC=NC2=C1CN=N2 Amb28455778 [1,0,0,0,0,0|2,1,0]=4 139 B11R2.106 S=C1NC=Nc2sccc21 Amb18526871 [1,0,0,0,0,0|2,1,0]=4 140 B11R2.106 S=C1NCN=C2N=CN=C12 Amb22015145 [1,0,0,0,0,0|0,1,2]=4 141 B13R2.654 CCC1=Nc2nonc2C(=O)N1 Amb27594472 [0,1,0,0,0,0|2,0,1]=4 142 B13R2.654 CCC1=Nc2sccc2C(=O)N1 Amb33546261 [0,1,0,0,0,0|3,0,0]=4 143 B13R2.654 CNC1N=C2N=CN=C2C(=O)N1 Amb22015190 [0,1,0,0,0,0|1,0,2]=4 144 B13R2.654 COC1=Nc2ncnn2C(=O)N1 Amb27224780 [0,1,0,0,0,0|2,0,1]=4 145 B13R2.654 CSC1=Nc2ccsc2C(=O)N1 Amb19748040 [0,1,0,0,0,0|3,0,0]=4 146 B13R2.654 CSC1=Nc2nccn2C(=O)N1 Amb27389336 [0,1,0,0,0,0|3,0,0]=4 147 B13R2.654 CSC1=Nc2ncnn2C(=O)N1 Amb27390176 [0,1,0,0,0,0|2,0,1]=4 148 B13R2.654 CSC1=Nc2nsnc2C(=O)N1 Amb23525020 [0,1,0,0,0,0|2,0,1]=4 149 B13R2.654 NCC1=Nc2ccsc2C(=O)N1 Amb18946431 [0,1,0,0,0,0|3,0,0]=4 150 B13R2.654 NCC1=Nc2occc2C(=O)N1 Amb18828598 [0,1,0,0,0,0|3,0,0]=4 151 B13R2.654 NCC1=Nc2sccc2C(=O)N1 Amb18039841 [0,1,0,0,0,0|3,0,0]=4 152 B13R2.654 NNC1=Nc2ccsc2C(=O)N1 Amb21988246 [0,1,0,0,0,0|3,0,0]=4 153 B13R2.654 NNC1=Nc2sccc2C(=O)N1 Amb21932842 [0,1,0,0,0,0|3,0,0]=4 154 B13R2.654 O=C1NC(CCl)=Nc2ccsc21 Amb19204307 [0,1,0,0,0,0|2,1,0]=4 155 B13R2.654 O=C1NC(CCl)=Nc2sccc21 Amb33528498 [0,1,0,0,0,0|2,1,0]=4 156 B13R2.654 O=C1NC(CO)=Nc2ccsc21 Amb18185427 [0,1,0,0,0,0|3,0,0]=4 157 B13R2.3742 CC1=Nc2c(C)csc2C(=O)N1 Amb27854429 [0,1,0,0,0,0|3,0,0]=4 158 B13R2.3742 Cc1csc2c1N=C(Cl)NC2=O Amb25696647 [0,1,0,0,0,0|2,1,0]=4 159 B13R2.3742 Cn1ccc2c1N=C(Cl)NC2=O Amb23399868 [0,1,0,0,0,0|1,1,1]=4 160 B13R2.3742 Cn1ccc2c1N=C(N)NC2=O Amb18646008 [0,1,0,0,0,0|2,0,1]=4 161 B13R2.3742 NC1=Nc2c(ncn2N)C(=O)N1 Amb18646438 [0,1,0,0,0,0|1,0,2]=4 162 B13R2.4899 CC1=Nc2ccsc2C(=O)N1N Amb20412564 [0,1,0,0,0,0|3,0,0]=4 163 B13R2.4899 CC1=Nc2sccc2C(=O)N1N Amb19210445 [0,1,0,0,0,0|3,0,0]=4 164 B13R2.4899 CN1C(=O)c2ccsc2N=C1Cl Amb27389960 [0,1,0,0,0,0|2,1,0]=4 165 B13R2.4899 CN1C(=O)c2ccsc2N=C1S Amb19372285 [0,1,0,0,0,0|3,0,0]=4 166 B13R2.4899 CN1C(=O)c2sccc2N=C1Cl Amb24456387 [0,1,0,0,0,0|2,1,0]=4 167 B13R2.4899 CN1C(=O)c2sccc2N=C1S Amb18330915 [0,1,0,0,0,0|3,0,0]=4 168 B13R2.5232 CC1(N)N=C2N=CN=C2C(=O)N1 Amb27955254 [0,1,0,0,0,0|1,0,2]=4 169 B13R2.5232 NC1(F)N=C2N=CN=C2C(=O)N1 Amb27870820 [0,1,0,0,0,0|0,1,2]=4 170 B13R2.5397 CC1=CC(=O)N2NC(N)=NC2=N1 Amb21922494 [0,1,0,0,0,0|3,0,0]=4 171 B13R2.5397 CC1=NC2=NC(=O)NC(=O)C2=N1 Amb26352507 [0,1,0,0,0,0|1,0,1]=3 172 B13R2.5397 CC1=Nc2nc(N)nn2C(=O)N1 Amb27777011 [0,1,0,0,0,0|2,0,1]=4 173 B13R2.5397 CC1=Nc2oc(C)nc2C(=O)N1 Amb19516703 [0,1,0,0,0,0|2,0,1]=4 174 B13R2.5397 CC1=Nc2sc(Br)cc2C(=O)N1 Amb18155610 [0,1,0,0,0,0|3,0,0]=4 175 B13R2.5397 CC1=Nc2sc(N)cc2C(=O)N1 Amb18824138 [0,1,0,0,0,0|3,0,0]=4 176 B13R2.5397 Cc1cc2c(s1)N=C(N)NC2=O Amb18034582 [0,1,0,0,0,0|3,0,0]=4 177 B13R2.5397 Cc1cc2c(s1)N=C(S)NC2=O Amb17992861 [0,1,0,0,0,0|3,0,0]=4 178 B13R2.5397 Cc1nc2c(o1)N=C(N)NC2=O Amb27255472 [0,1,0,0,0,0|2,0,1]=4 179 B13R2.5397 Cc1nc2n(n1)C(=O)NC(Br)=C2 Amb18755659 [0,1,0,0,0,0|2,0,1]=4 180 B13R2.5397 NC1=NC(=O)C2=NC(N)=NC2=N1 Amb27458880 [0,1,0,0,0,0|1,0,2]=4 181 B13R2.5397 NC1=NC2=C(NC(O)N2)C(=O)N1 Amb24485488 [0,1,0,0,0,0|1,0,2]=4 182 B13R2.5397 NC1=NC2=C(SC(=S)S2)C(=O)N1 Amb27752062 [0,1,0,0,0,0|3,0,0]=4 183 B13R2.5397 NC1=NC2=NC(=S)N=C2C(=O)N1 Amb27984911 [0,1,0,0,0,0|1,0,1]=3 184 B13R2.5397 NC1=Nc2nc(Cl)sc2C(=O)N1 Amb19130406 [0,1,0,0,0,0|2,0,0]=3 185 B13R2.5397 NC1=Nc2nc(S)sc2C(=O)N1 Amb28123139 [0,1,0,0,0,0|2,0,0]=3 186 B13R2.5397 NC1N=C2N=C(Cl)N=C2C(=O)N1 Amb22015185 [0,1,0,0,0,0|1,0,2]=4 187 B13R2.5397 NC1N=C2N=C(O)N=C2C(=O)N1 Amb22015186 [0,1,0,0,0,0|1,0,2]=4 188 B13R2.5397 O=C1N=C2C(=O)NC(=S)N=C2N1 Amb28243829 [0,1,0,0,0,0|1,0,2]=4 189 B13R2.5397 O=C1N=C2N=C(Br)N=C2C(=O)N1 Amb22015335 [0,1,0,0,0,0|1,0,1]=3 190 B13R2.5397 O=C1N=C2N=C(Cl)NC(Cl)=C2N1 Amb24558352 [0,1,0,0,0,0|1,1,0]=3 191 B13R2.5397 O=C1N=C2NC(=S)NC(=O)C2N1 Amb27861121 [0,1,0,0,0,0|1,0,2]=4 192 B13R2.5397 O=C1NC(=O)C2=C(N1)NC(=O)N2 Amb18805774 [0,1,0,0,0,0|1,0,2]=4 193 B13R2.5397 O=C1NC(=S)NC2=C1NC(=S)N2 Amb19090233 [0,1,0,0,0,0|1,0,2]=4 194 B13R2.11642 CC1=Cc2ccn(C)c2C(=O)N1 Amb19149147 [0,1,0,0,0,0|3,0,0]=4 195 B13R2.11642 CC1=Nc2ncn(C)c2C(=O)N1 Amb23571148 [0,1,0,0,0,0|1,0,0]=2 196 B13R2.11642 Cc1csc2c1C(=O)NC(Cl)=N2 Amb27166036 [0,1,0,0,0,0|2,1,0]=4 197 B13R2.11642 Cc1csc2c1C(=O)NC(S)=N2 Amb18330884 [0,1,0,0,0,0|3,0,0]=4 198 B13R2.11642 Cc1nc(Cl)c2c(ncn2C)n1 Amb23571149 [0,1,0,0,0,0|2,0,1]=4 199 B13R2.11642 Cc1nc(N)c2c(ncn2C)n1 Amb18829335 [0,1,0,0,0,0|2,0,1]=4 200 B13R2.11642 Cn1ccc2c1C(=O)NC(Cl)=N2 Amb21963249 [0,1,0,0,0,0|1,1,0]=3 201 B13R2.11642 Cn1cnc2c1C(=O)N=C(N)N2 Amb20672088 [0,1,0,0,0,0|1,0,2]=4 202 B13R2.11642 Cn1cnc2c1C(=O)NC(Br)=N2 Amb18755665 [0,1,0,0,0,0|0,0,0]=1 203 B13R2.11642 Cn1cnc2c1C(=O)NC(Cl)=N2 Amb19825391 [0,1,0,0,0,0|0,1,0]=2 204 B13R2.11642 Cn1cnc2c1C(=O)NC(N)=N2 Amb18646243 [0,1,0,0,0,0|1,0,0]=2 205 B13R2.11642 Cn1cnc2c1C(=O)NC(N)=N2 Amb23400883 [0,1,0,0,0,0|1,0,0]=2 206 B13R2.11642 Cn1cnc2nc(Br)cc(Cl)c21 Amb22751047 [0,1,0,0,0,0|2,0,0]=3 207 B13R2.11642 Cn1cnc2nc(Cl)cc(Br)c21 Amb22751045 [0,1,0,0,0,0|2,1,0]=4 208 B13R2.11642 Cn1cnc2nc(Cl)cc(Cl)c21 Amb22751043 [0,1,0,0,0,0|2,1,0]=4 209 B13R2.11642 Cn1cnc2nc(Cl)nc(Cl)c21 Amb533458 [0,1,0,0,0,0|1,1,1]=4 210 B13R2.11642 Cn1cnc2nc(Cl)nc(N)c21 Amb8439327 [0,1,0,0,0,0|1,1,1]=4 211 B13R2.11642 Cn1cnc2nc(Cl)nc(O)c21 Amb8629125 [0,1,0,0,0,0|0,1,2]=4 212 B13R2.11642 Cn1cnc2nc(N)nc(Cl)c21 Amb27193053 [0,1,0,0,0,0|2,0,1]=4 213 B13R2.11642 Cn1cnc2nc(N)nc(N)c21 Amb24537634 [0,1,0,0,0,0|2,0,1]=4 214 B13R2.11642 Cn1cnc2nc(O)nc(Br)c21 Amb18161521 [0,1,0,0,0,0|2,0,1]=4 215 B13R2.11642 Cn1cnc2nc(O)nc(O)c21 Amb22732256 [0,1,0,0,0,0|1,0,2]=4 216 B13R2.11642 Cn1cnc2nc(S)nc(S)c21 Amb4007865 [0,1,0,0,0,0|1,1,1]=4 217 B13R2.11642 Cn1ncc2c1C(=O)NC(Cl)=N2 Amb23399858 [0,1,0,0,0,0|2,1,0]=4 218 B13R2.11642 Cn1nnc2c1C(=O)NC(=O)N2 Amb27638133 [0,1,0,0,0,0|2,0,1]=4 219 B13R2.11642 Cn1nnc2c1C(=O)NC(N)=N2 Amb27426757 [0,1,0,0,0,0|2,0,0]=3 220 B13R2.11642 O=C1NC(=O)c2c(ncn2O)N1 Amb24399306 [0,1,0,0,0,0|1,0,1]=3 221 B11R1.8 CC1=NC(C#N)=C(N)C(=O)N1 Amb25707638 [0,0,1,0,0,0|3,0,0]=4 222 B11R1.34 CC1=NC(CCN)=CC(=O)N1 Amb18042421 [0,0,1,0,0,0|2,0,1]=4 223 B11R1.34 NCCC1=CC(=O)NC(N)=N1 Amb18831024 [0,0,1,0,0,0|2,0,1]=4 224 B11R1.81 O=CNC1=CNC(=O)NC1=O Amb19754274 [0,0,1,0,0,0|2,0,1]=4 225 B11R1.81 O=CNc1cnc(Br)cc1Br Amb24707913 [0,0,1,0,0,0|3,0,0]=4 226 B11R2.8 CC1=Nc2sccc2C1=O Amb5721189 [0,0,0,0,1,0|3,0,0]=4 227 B11R2.202 O=C1NC(Br)=C2NC=CN12 Amb27636550 [0,0,0,0,1,0|2,0,1]=4 228 B13R2.328 Brc1cc(Br)c2cccnc2n1 Amb22491974 [0,0,0,0,0,1|3,0,0]=4 229 B13R2.328 Brc1cc(Br)c2ccncc2n1 Amb33549016 [0,0,0,0,0,1|3,0,0]=4 230 B13R2.328 CC1=CC(=O)N2NC=NNC2=N1 Amb19552176 [0,0,0,0,0,1|3,0,0]=4 231 B13R2.328 CC1=Cc2cnccc2C(=O)N1 Amb25891932 [0,0,0,0,0,1|3,0,0]=4 232 B13R2.328 CC1=Nc2ccccc2C(=O)N1 Amb17997717 [0,0,0,0,0,1|3,0,0]=4 233 B13R2.328 CC1=Nc2cnccc2C(=O)N1 Amb20668477 [0,0,0,0,0,1|2,0,0]=3 234 B13R2.328 CC1=Nc2cnccc2C(=O)O1 Amb26590766 [0,0,0,0,0,1|3,0,0]=4 235 B13R2.328 CC1=Nc2cnncc2C(=O)N1 Amb27393068 [0,0,0,0,0,1|3,0,0]=4 236 B13R2.328 CC1=Nc2ncccc2C(=O)N1 Amb18034920 [0,0,0,0,0,1|2,0,0]=3 237 B13R2.328 CC1=Nc2ncccc2C(=O)O1 Amb22524594 [0,0,0,0,0,1|3,0,0]=4 238 B13R2.328 CC1=Nc2nccnc2C(=O)N1 Amb23592209 [0,0,0,0,0,1|1,0,1]=3 239 B13R2.328 CC1=Nc2ncncc2C(=S)N1 Amb27265872 [0,0,0,0,0,1|1,1,1]=4 240 B13R2.328 Clc1nc(Br)nc2ncccc12 Amb28046354 [0,0,0,0,0,1|2,0,1]=4 241 B13R2.328 NC1=NC(=O)C2=CC=NNC2=N1 Amb18645783 [0,0,0,0,0,1|2,0,1]=4 242 B13R2.328 NC1=NC2=C(N=CCN2)C(=O)N1 Amb18646240 [0,0,0,0,0,1|1,0,2]=4 243 B13R2.328 NC1=Nc2ccccc2C(=O)N1 Amb17933195 [0,0,0,0,0,1|3,0,0]=4 244 B13R2.328 NC1=Nc2ncccc2C(=O)N1 Amb18645610 [0,0,0,0,0,1|2,0,0]=3 245 B13R2.328 NC1=Nc2nccnc2C(=O)N1 Amb18645782 [0,0,0,0,0,1|1,0,1]=3 246 B13R2.328 NC1=Nc2nccnc2C(=S)N1 Amb25794162 [0,0,0,0,0,1|1,1,1]=4 247 B13R2.328 NC1=Nc2nncnc2C(=O)N1 Amb27433956 [0,0,0,0,0,1|1,0,1]=3 248 B13R2.328 Nc1nc(N)c2c(n1)N=CCN2 Amb27876032 [0,0,0,0,0,1|2,0,1]=4 249 B13R2.328 O=C1Cc2ncccc2C(=O)N1 Amb27827917 [0,0,0,0,0,1|3,0,0]=4 250 B13R2.328 O=C1N=C2C=NC=CN2C(=O)N1 Amb27404794 [0,0,0,0,0,1|3,0,0]=4 251 B13R2.328 O=C1N=C2NN=CC=C2C(=O)N1 Amb21964056 [0,0,0,0,0,1|2,0,0]=3 252 B13R2.328 O=C1NC(=O)c2cccnc2N1 Amb22001013 [0,0,0,0,0,1|2,0,1]=4 253 B13R2.328 O=C1NC(=O)c2cccnc2S1 Amb27597456 [0,0,0,0,0,1|3,0,0]=4 254 B13R2.328 O=C1NC(=O)c2ccncc2N1 Amb19515865 [0,0,0,0,0,1|2,0,1]=4 255 B13R2.328 O=C1NC(=O)c2nccnc2N1 Amb21913206 [0,0,0,0,0,1|1,0,2]=4 256 B13R2.328 O=C1NC(=O)c2ncnnc2N1 Amb27814240 [0,0,0,0,0,1|1,0,2]=4 257 B13R2.328 O=C1NC(=S)Nc2cnccc21 Amb22728587 [0,0,0,0,0,1|2,0,1]=4 258 B13R2.328 O=C1NC(=S)Nc2ncccc21 Amb22235929 [0,0,0,0,0,1|2,0,1]=4 259 B13R2.328 O=C1NC(Br)=Cc2ccccc21 Amb25971614 [0,0,0,0,0,1|3,0,0]=4 260 B13R2.328 O=C1NC(Cl)=Nc2ccccc21 Amb20171410 [0,0,0,0,0,1|2,1,0]=4 261 B13R2.328 O=C1NC(Cl)=Nc2cnccc21 Amb23556685 [0,0,0,0,0,1|1,1,0]=3 262 B13R2.328 O=C1NC(Cl)=Nc2nccnc21 Amb26489042 [0,0,0,0,0,1|0,1,1]=3 263 B13R2.328 O=C1NC(S)=Nc2ccccc21 Amb19517606 [0,0,0,0,0,1|3,0,0]=4 264 B13R2.328 Oc1cc(Br)nc2ncccc12 Amb25313324 [0,0,0,0,0,1|2,0,1]=4 265 B10R1.2 CNC1=C(N)C(=O)NC=N1 Amb22753463 [1,0,1,0,0,0|0,0,2]=4 266 B10R1.2 COC1=C(N)C(=O)NC=N1 Amb25350629 [1,0,1,0,0,0|1,0,1]=4 267 B10R1.8 CC1=NC(C=O)=CC(=O)N1 Amb27414037 [1,0,1,0,0,0|2,0,0]=4 268 B10R1.8 CC1=NC(CN)=CC(=O)N1 Amb18544340 [1,0,1,0,0,0|1,0,1]=4 269 B10R1.8 NCC1=CC(=O)NC(N)=N1 Amb18831917 [1,0,1,0,0,0|1,0,1]=4 270 B10R1.8 NCC1=CC(=O)NC(S)=N1 Amb18830624 [1,0,1,0,0,0|1,0,1]=4 271 B10R1.8 NCC1=CC(=O)NC(S)=N1 Amb28721448 [1,0,1,0,0,0|1,0,1]=4 272 B10R1.22 CC1=C(N)C(=O)NC(N)=N1 Amb18643530 [1,0,1,0,0,0|1,0,1]=4 273 B10R1.22 NC1=NC(Cl)=C(N)C(=O)N1 Amb28126716 [1,0,1,0,0,0|2,0,0]=4 274 B10R1.10 [N-]=[N+]=NC1=CC(=O)NC=N1 Amb28050367 [1,0,1,0,0,0|1,0,1]=4 275 B10R1.25 NC1=NC=C(C=O)C(=O)N1 Amb35825141 [1,0,1,0,0,0|2,0,0]=4 276 B10R2.7 c1cnc2ncoc2c1 Amb17194206 [2,0,0,0,0,0|2,0,0]=4 277 B10R2.7 c1cnc2ncsc2c1 Amb22002122 [2,0,0,0,0,0|2,0,0]=4 278 B12R1.101 NC(=O)CC1=CC(=O)NC(N)=N1 Amb20093599 [0,1,1,0,0,0|2,0,0]=4 279 B12R1.101 NC(=O)CC1=CC(=O)NC(S)=N1 Amb20636096 [0,1,1,0,0,0|2,0,0]=4 280 B12R1.69 CC1=NC=C(CNC=O)C(=O)N1 Amb25312063 [0,1,1,0,0,0|2,0,0]=4 281 B12R1.69 CC1=NC=C(CNC=S)C(=O)N1 Amb27223922 [0,1,1,0,0,0|2,0,0]=4 282 B12R1.544 CN1C(=O)C(NC=O)=CN=C1N Amb27778034 [0,1,1,0,0,0|2,0,0]=4 283 B12R2.606 Cc1nc2nc(Br)ccc2o1 Amb20668010 [1,1,0,0,0,0|2,0,0]=4 284 B12R2.606 Nc1nc2nc(Br)ccc2o1 Amb32681923 [1,1,0,0,0,0|2,0,0]=4 285 B12R2.606 Nc1nc2nc(Br)ccc2s1 Amb23437376 [1,1,0,0,0,0|2,0,0]=4 286 B12R2.606 Nc1nc2nc(Br)ncc2s1 Amb18748796 [1,1,0,0,0,0|1,0,1]=4 287 B12R2.606 O=C1Cc2nc(Br)ccc2N1 Amb6307207 [1,1,0,0,0,0|2,0,0]=4 288 B12R2.606 O=C1Nc2ccc(Br)nc2N1 Amb27600680 [1,1,0,0,0,0|1,0,1]=4 289 B12R2.606 O=C1Nc2ccc(Br)nc2O1 Amb27196475 [1,1,0,0,0,0|2,0,0]=4 290 B12R2.606 O=C1Nc2cnc(Br)nc2N1 Amb28368648 [1,1,0,0,0,0|0,0,2]=4 291 B12R2.612 Cn1ccc2nc(Br)ccc21 Amb34199879 [1,1,0,0,0,0|2,0,0]=4 292 B12R2.612 Cn1cnc2cc(Br)ccc21 Amb33548917 [1,1,0,0,0,0|2,0,0]=4 293 B12R2.612 Cn1cnc2cc(Br)ncc21 Amb32664949 [1,1,0,0,0,0|1,0,1]=4 294 B12R2.612 Cn1cnc2nc(Br)ccc21 Amb25082493 [1,1,0,0,0,0|1,0,0]=3 295 B12R2.612 Cn1cnc2nc(Cl)ccc21 Amb26353240 [1,1,0,0,0,0|1,1,0]=4 296 B12R2.612 Cn1cnc2nc(Cl)ncc21 Amb25785712 [1,1,0,0,0,0|0,1,1]=4 297 B12R2.196 Cn1cnc2c1N=CNC2=O Amb19892443 [1,1,0,0,0,0|0,0,2]=4 298 B12R2.196 Nc1csc2c1N=CNC2=O Amb26034593 [1,1,0,0,0,0|2,0,0]=4 299 B12R2.196 O=C1NC=Nc2c(Br)coc21 Amb22497843 [1,1,0,0,0,0|2,0,0]=4 300 B12R2.196 O=C1NC=Nc2c(Cl)csc21 Amb27636702 [1,1,0,0,0,0|2,0,0]=4 301 B12R2.202 CC1=C2NC(=S)N=C2N=CN1 Amb26946365 [1,1,0,0,0,0|1,0,0]=3 302 B12R2.202 Cc1cc2c(o1)N=CNC2=O Amb24356598 [1,1,0,0,0,0|2,0,0]=4 303 B12R2.202 Cc1cc2c(s1)C(=O)NC=N2 Amb24679534 [1,1,0,0,0,0|2,0,0]=4 304 B12R2.202 Cc1cc2c(s1)N=CNC2=O Amb18371815 [1,1,0,0,0,0|2,0,0]=4 305 B12R2.202 Cc1cc2n(n1)N=CNC2=O Amb25843493 [1,1,0,0,0,0|2,0,0]=4 306 B12R2.202 Cc1nc2c(o1)N=CNC2=O Amb19516702 [1,1,0,0,0,0|1,0,1]=4 307 B12R2.202 Cc1nc2c(s1)C(=O)NC=N2 Amb24501977 [1,1,0,0,0,0|1,0,0]=3 308 B12R2.202 Cn1cc2c(n1)N=CNC2=O Amb24079499 [1,1,0,0,0,0|2,0,0]=4 309 B12R2.202 NC1=NC2=NC=NC(=O)C2=C1 Amb27836000 [1,1,0,0,0,0|1,0,1]=4 310 B12R2.202 Nc1cc2c(s1)N=CNC2=O Amb18199493 [1,1,0,0,0,0|2,0,0]=4 311 B12R2.202 Nc1nc2c(s1)C(=O)NC=N2 Amb18199306 [1,1,0,0,0,0|1,0,0]=3 312 B12R2.202 O=C1N=C2C=CNC(=O)N2N1 Amb29847945 [1,1,0,0,0,0|2,0,0]=4 313 B12R2.202 O=C1NC2=C(C=CNC2=O)O1 Amb27464604 [1,1,0,0,0,0|2,0,0]=4 314 B12R2.202 O=C1NC=Nc2cc(Cl)sc21 Amb27817554 [1,1,0,0,0,0|2,0,0]=4 315 B12R2.202 O=C1NC=Nc2sc(Br)cc21 Amb18160525 [1,1,0,0,0,0|2,0,0]=4 316 B12R2.202 O=C1NC=Nc2sc(Cl)cc21 Amb25952512 [1,1,0,0,0,0|2,0,0]=4 317 B12R2.203 CC1=C2C(=O)N=CN=C2N=C1 Amb27201801 [1,1,0,0,0,0|1,0,1]=4 318 B12R2.203 Cc1coc2c1C(=O)NC=N2 Amb20529507 [1,1,0,0,0,0|2,0,0]=4 319 B12R2.203 Cc1csc2c1C(=O)NC=N2 Amb19665762 [1,1,0,0,0,0|2,0,0]=4 320 B12R2.203 Cn1ccc2c1C(=O)NC=C2 Amb19330391 [1,1,0,0,0,0|2,0,0]=4 321 B12R2.203 Cn1ccc2c1C(=O)NC=N2 Amb22001591 [1,1,0,0,0,0|1,0,0]=3 322 B12R2.203 Cn1cnc2c1C(=O)NC=C2 Amb27476482 [1,1,0,0,0,0|1,0,0]=3 323 B12R2.203 Cn1cnc2c1C(=O)NCC2 Amb18201688 [1,1,0,0,0,0|1,0,1]=4 324 B12R2.203 Cn1cnc2nccc(Cl)c21 Amb28066549 [1,1,0,0,0,0|2,0,0]=4 325 B12R2.203 Cn1cnc2nccc(N)c21 Amb22500745 [1,1,0,0,0,0|2,0,0]=4 326 B12R2.203 Cn1cnc2ncnc(Cl)c21 Amb4108186 [1,1,0,0,0,0|1,0,1]=4 327 B12R2.203 Cn1cnc2ncnc(F)c21 Amb22498178 [1,1,0,0,0,0|1,0,1]=4 328 B12R2.203 Cn1cnc2ncnc(N)c21 Amb6356158 [1,1,0,0,0,0|1,0,1]=4 329 B12R2.203 Cn1cnc2ncnc(O)c21 Amb23412004 [1,1,0,0,0,0|0,0,2]=4 330 B12R2.203 Cn1nnc2c1C(=O)NC=N2 Amb27830111 [1,1,0,0,0,0|1,0,0]=3 331 B12R2.203 Nn1cnc2ncnc(Cl)c21 Amb27850550 [1,1,0,0,0,0|1,0,1]=4 332 B12R2.203 O=C1NC=Nc2ncn(O)c21 Amb25132173 [1,1,0,0,0,0|0,0,0]=2 333 B12R2.203 O=C1NC=Nc2scc(Br)c21 Amb22727953 [1,1,0,0,0,0|2,0,0]=4 334 B12R2.315 N#CC1=C2NCN=C2N=CN1 Amb26477856 [1,1,0,0,0,0|1,0,1]=4 335 B12R2.5342 O=C1NC2=C(N1)C(=O)NC2=O Amb27806663 [0,1,0,0,1,0|1,0,1]=4 336 B14R2.29306 Cn1cnc2c1C(=O)NCC(=S)N2 Amb27469704 [0,1,0,0,0,1|1,0,1]=4 337 B14R2.1019 CCC1=Nc2nccnc2C(=O)N1 Amb23560750 [0,1,0,0,0,1|1,0,1]=4 338 B14R2.1019 CNC1=Nc2nccnc2C(=O)N1 Amb24309511 [0,1,0,0,0,1|1,0,1]=4 339 B14R2.1019 COC1=Nc2ncccc2C(=O)N1 Amb27400281 [0,1,0,0,0,1|2,0,0]=4 340 B14R2.1019 COC1=Nc2nccnc2C(=O)N1 Amb27965414 [0,1,0,0,0,1|1,0,1]=4 341 B14R2.1019 CSC1=Nc2cnccc2C(=O)N1 Amb27431592 [0,1,0,0,0,1|2,0,0]=4 342 B14R2.1019 CSC1=Nc2ncccc2C(=O)N1 Amb27587066 [0,1,0,0,0,1|2,0,0]=4 343 B14R2.1019 CSC1=Nc2nccnc2C(=O)N1 Amb24757578 [0,1,0,0,0,1|1,0,1]=4 344 B14R2.1019 NCC1=Nc2ncccc2C(=O)N1 Amb26601009 [0,1,0,0,0,1|2,0,0]=4 345 B14R2.1019 NCC1=Nc2nccnc2C(=O)N1 Amb27848939 [0,1,0,0,0,1|1,0,1]=4 346 B14R2.1019 O=C1NC(CCl)=Nc2cnccc21 Amb27480367 [0,1,0,0,0,1|1,1,0]=4 347 B14R2.1019 O=C1NC(CCl)=Nc2nccnc21 Amb27592534 [0,1,0,0,0,1|0,1,1]=4 348 B14R2.8045 CC1=Nc2c(N)ncnc2C(=O)N1 Amb27790847 [0,1,0,0,0,1|1,0,1]=4 349 B14R2.8045 NC1=Nc2c(ccnc2Cl)C(=O)N1 Amb26633664 [0,1,0,0,0,1|2,0,0]=4 350 B14R2.8188 CN1C(=O)c2ccccc2N=C1Br Amb27636724 [0,1,0,0,0,1|2,0,0]=4 351 B14R2.8188 CN1C(=O)c2cccnc2N=C1S Amb24398927 [0,1,0,0,0,1|2,0,0]=4 352 B14R2.8235 CC1=CNC2=C(N1)C(=O)NC(N)=N2 Amb27858865 [0,1,0,0,0,1|1,0,1]=4 353 B14R2.8235 CC1=NNC2=C(C1)C(=O)NC(N)=N2 Amb18128395 [0,1,0,0,0,1|2,0,0]=4 354 B14R2.8235 CC1=Nc2cnc(Cl)cc2C(=O)N1 Amb22751262 [0,1,0,0,0,1|2,0,0]=4 355 B14R2.8235 CC1=Nc2ncc(Br)nc2C(=O)N1 Amb23559674 [0,1,0,0,0,1|1,0,1]=4 356 B14R2.8235 CN1C=NC2=NC(N)=NC(=O)C2=C1 Amb27230177 [0,1,0,0,0,1|1,0,1]=4 357 B14R2.8235 Cc1cnc2c(c1)C(=O)NC(N)=N2 Amb18647957 [0,1,0,0,0,1|2,0,0]=4 358 B14R2.8235 Cc1nnc2c(n1)C(=O)NC(N)=N2 Amb27484132 [0,1,0,0,0,1|1,0,1]=4 359 B14R2.8235 NC1=CNC2=C(N1)C(=O)NC(N)=N2 Amb27462148 [0,1,0,0,0,1|1,0,1]=4 360 B14R2.8235 NC1=NC2=C(NC(=O)C=N2)C(=O)N1 Amb18128309 [0,1,0,0,0,1|1,0,0]=3 361 B14R2.8235 NC1=NC2=C(NC(O)=CN2)C(=O)N1 Amb27415771 [0,1,0,0,0,1|1,0,1]=4 362 B14R2.8235 NC1=NC2=C(NC(O)C=N2)C(=O)N1 Amb25312189 [0,1,0,0,0,1|1,0,0]=3 363 B14R2.8235 NC1=Nc2ncc(Br)cc2C(=O)N1 Amb18135252 [0,1,0,0,0,1|2,0,0]=4 364 B14R2.8235 NC1=Nc2ncc(N)cc2C(=O)N1 Amb21999970 [0,1,0,0,0,1|2,0,0]=4 365 B14R2.8235 NC1=Nc2nnc(N)nc2C(=O)N1 Amb27650652 [0,1,0,0,0,1|1,0,1]=4 366 B14R2.8235 O=C1NC(S)=Nc2ncc(Br)cc21 Amb27826102 [0,1,0,0,0,1|2,0,0]=4 367 B14R2.28480 Cc1ccnc2c1C(=O)NC(N)=N2 Amb27618720 [0,1,0,0,0,1|2,0,0]=4 368 B14R2.29365 CC1=Nc2nc(N)nnc2C(=O)N1 Amb27180079 [0,1,0,0,0,1|1,0,1]=4 369 B14R2.29365 Cc1ccc2c(n1)N=C(Cl)NC2=O Amb32416557 [0,1,0,0,0,1|1,1,0]=4 370 B14R2.29365 Cc1ccc2c(n1)N=C(N)NC2=O Amb27878552 [0,1,0,0,0,1|2,0,0]=4 371 B14R2.587 O=C1NC(CCBr)=Nc2sccc21 Amb18538245 [0,2,0,0,0,0|2,0,0]=4 372 B14R2.8824 CC(Br)C1=Nc2ccsc2C(=O)N1 Amb27254796 [0,2,0,0,0,0|2,0,0]=4 373 B14R2.8824 CC(Br)C1=Nc2sccc2C(=O)N1 Amb28283838 [0,2,0,0,0,0|2,0,0]=4 374 B14R2.36882 COC1=Nc2ncn(C)c2C(=O)N1 Amb27257931 [0,2,0,0,0,0|1,0,0]=3 375 B14R2.36882 COC1=Nc2nnn(C)c2C(=O)N1 Amb27827375 [0,2,0,0,0,0|2,0,0]=4 376 B14R2.25595 Cn1c[n+](C)c2c1C(=O)NC([O-])=N2 Amb26627962 [0,2,0,0,0,0|1,0,1]=4 377 B14R2.24376 CN1C(=O)Nc2ncn(C)c2C1=O Amb19133593 [0,2,0,0,0,0|1,0,1]=4 378 B14R2.24376 CN1C(=O)Nc2ncn(O)c2C1=O Amb27230621 [0,2,0,0,0,0|1,0,1]=4 379 B14R2.5745 CN1C(=O)NC(=O)c2c1ncn2C Amb18186527 [0,2,0,0,0,0|1,0,1]=4 380 B14R2.5745 CN1C(=O)NC(=O)c2c1ncn2N Amb27778482 [0,2,0,0,0,0|1,0,1]=4 381 B14R2.5745 Cn1cnc2c1C(=O)NC(=N)N2O Amb24415372 [0,2,0,0,0,0|1,0,1]=4 382 B14R2.27750 CN1C(=O)NC2=C1C(=O)NC(N)=N2 Amb24417716 [0,2,0,0,0,0|1,0,1]=4 383 B14R2.27750 Cc1cc2c(n1C)C(=O)NC(S)=N2 Amb25689999 [0,2,0,0,0,0|2,0,0]=4 384 B14R2.27750 Cc1nc2c(n1C)C(=O)NC(N)=N2 Amb18194756 [0,2,0,0,0,0|1,0,0]=3 385 B14R2.27750 Cn1c(N)nc2c1C(=O)NC(N)=N2 Amb27771843 [0,2,0,0,0,0|1,0,0]=3 386 B14R2.38331 N\N=C1/NC2=C(N1)C(=O)NC(N)=N2 Amb24634642 [0,2,0,0,0,0|1,0,1]=4 387 B14R2.38331 [N-]=[N+]=C1N=C2N=C(N)NC(=O)C2=N1 Amb24374190 [0,2,0,0,0,0|1,0,1]=4 388 B14R2.12158 CCn1ccc2c1C(=O)NC(Cl)=N2 Amb22276204 [0,2,0,0,0,0|1,1,0]=4 389 B14R2.12158 CCn1cnc2c1C(=O)NC(N)=N2 Amb19666305 [0,2,0,0,0,0|1,0,0]=3 390 B10R2.68 O=C1NC=NC2=C1CC2 Amb27411890 [1,0,0,0,1,0|1,0,1]=4 391 B12R1.54 C=C(Br)CNC(=O)c1cncs1 Amb27465403 [0,0,1,0,0,1|2,0,0]=4 392 B12R1.107 N=C(N)NC(=O)c1ccncc1 Amb24184121 [0,0,1,0,0,1|2,0,0]=4 393 B12R1.107 N=C(N)NC(=O)c1cnccn1 Amb28600206 [0,0,1,0,0,1|1,0,1]=4 394 B12R2.1081 O=C1NC=Cc2cnccc21 Amb20241097 [1,0,0,0,0,1|2,0,0]=4 395 B12R2.1081 O=C1NC=Cc2ncccc21 Amb19882327 [1,0,0,0,0,1|2,0,0]=4 396 B12R2.1081 O=C1NC=Cc2nccnc21 Amb22489852 [1,0,0,0,0,1|1,0,1]=4 397 B12R2.1081 O=C1NC=Cc2ncncc21 Amb24119509 [1,0,0,0,0,1|1,0,1]=4 398 B12R2.1081 O=C1NC=Cc2ncnnc21 Amb27250748 [1,0,0,0,0,1|1,0,1]=4 399 B12R2.1081 O=C1NC=NC2=C1CC=CC2 Amb26330823 [1,0,0,0,0,1|2,0,0]=4 400 B12R2.1081 O=C1NC=NC2=C1CC=NN2 Amb27254310 [1,0,0,0,0,1|1,0,0]=3 401 B12R2.1081 O=C1NC=NC2=C1CNCC2 Amb19375085 [1,0,0,0,0,1|1,0,1]=4 402 B12R2.1081 O=C1NC=NC2=C1CNCC2 Amb19958886 [1,0,0,0,0,1|1,0,1]=4 403 B12R2.1081 O=C1NC=NC2=C1CNCC2 Amb29083227 [1,0,0,0,0,1|1,0,1]=4 404 B12R2.1081 O=C1NC=Nc2ccccc21 Amb18012662 [1,0,0,0,0,1|2,0,0]=4 405 B12R2.1081 O=C1NC=Nc2ccncc21 Amb22001741 [1,0,0,0,0,1|1,0,1]=4 406 B12R2.1081 O=C1NC=Nc2ccnnc21 Amb25843281 [1,0,0,0,0,1|1,0,1]=4 407 B12R2.1081 O=C1NC=Nc2cnccc21 Amb19957554 [1,0,0,0,0,1|1,0,0]=3 408 B12R2.1081 O=C1NC=Nc2cnncc21 Amb27760126 [1,0,0,0,0,1|2,0,0]=4 409 B12R2.1081 O=C1NC=Nc2ncccc21 Amb18026152 [1,0,0,0,0,1|1,0,0]=3 410 B12R2.1081 O=C1NC=Nc2nccnc21 Amb19372625 [1,0,0,0,0,1|0,0,1]=3 411 B12R2.1081 O=C1NC=Nc2ncncc21 Amb22496184 [1,0,0,0,0,1|0,0,1]=3 412 B12R2.1081 O=C1NC=Nc2nnccc21 Amb22388525 [1,0,0,0,0,1|1,0,0]=3 413 B12R2.1081 O=C1NC=Nc2nncnc21 Amb27617268 [1,0,0,0,0,1|0,0,1]=3 414 B12R2.1081 Oc1ncnc2c1NCC=N2 Amb26905577 [1,0,0,0,0,1|0,0,2]=4 415 B12R2.1081 S=C1NC=Nc2ncncc21 Amb19374180 [1,0,0,0,0,1|0,1,1]=4