0 B19R3.19255 C1=CC2=C(C=C1)NC(=N2)SCC3CCCCO3 Z54070048 [0,0,0,0,0,0|3,0,0]=3 1 B19R3.19255 C1=CC2=C(C=C1)OC(=N2)NCC3CCCOC3 Z728925230 [0,0,0,0,0,0|3,1,0]=4 2 B19R3.19255 C1=CC2=C(C=C1)SC(=N2)NC[C@@H]3CCCNC3 Z3493723606 [0,0,0,0,0,0|3,0,0]=3 3 B20R3.277 CN1C(=NC2=C1C=CC=C2)CNC3CCCCC3 Z56803498 [0,1,0,0,0,0|2,0,0]=3 4 B20R3.277 CN1C(=NC2=C1C=CC=C2)CNC3CCOCC3 Z1071034408 [0,1,0,0,0,0|3,0,0]=4 5 B20R3.16119 CN(CC1=NC2=C(N1)C=CC=C2)C3CCNCC3 Z234896789 [0,1,0,0,0,0|3,0,0]=4 6 B20R3.16119 CN(CC1=NC2=C(S1)C=CC=C2)C3CCCCC3 Z54747669 [0,1,0,0,0,0|1,0,0]=2 7 B20R3.91525 CC1CCC/C(=N\NC2=NC3=C(S2)C=CC=C3)/C1 Z49559978 [0,1,0,0,0,0|1,0,2]=4 8 B20R3.94169 CC1=CC2=C(C=C1)NC(=N2)SCC3CCCCO3 Z18442866 [0,1,0,0,0,0|3,0,0]=4 9 B20R3.248100 FC1=C2SC(=NC2=CC=C1)NCC3CCOCC3 Z2271547250 [0,1,0,0,0,0|3,0,0]=4 10 B20R3.331219 CN(CC1CCCOC1)C2=NC3=C(S2)C=CC=C3 Z1152083255 [0,1,0,0,0,0|3,0,0]=4 11 B20R3.14686862 OC1(CCOCC1)CNC2=NC3=C(S2)C=CC=C3 Z1119710646 [0,1,0,0,0,0|3,0,0]=4 12 B18R2.1897 CCOCC(O)CSC1=NC2=C(S1)C=CC=C2 Z1178481352 [0,0,1,0,0,0|3,0,0]=4 13 B18R2.2429 O=C(CNC1CCCCC1)NC2=CC=CC=C2 Z52697982 [0,0,1,0,0,0|1,1,1]=4 14 B18R3.12728 C1=CC2=C(C=C1)OC(=C2)CNC3CCCC3 Z90515605 [0,0,0,0,1,0|2,1,0]=4 15 B18R3.12728 C1=CC2=C(C=C1)OC(=N2)CNC3CCCC3 Z123966592 [0,0,0,0,1,0|1,1,0]=3 16 B18R3.12728 C1=CC2=C(C=C1)SC(=N2)NCC3CCCO3 Z55176832 [0,0,0,0,1,0|3,0,0]=4 17 B18R3.12875 C1=CC2=C(C=C1)NC(=N2)CC3CCNCC3 Z2146515277 [0,0,0,0,1,0|3,0,0]=4 18 B18R3.12875 C1=CC2=C(C=C1)NC(=N2)SC3CCCCC3 Z826561556 [0,0,0,0,1,0|1,0,0]=2 19 B18R3.12875 C1=CC2=C(C=C1)OC(=N2)CN3CCCCC3 Z103698910 [0,0,0,0,1,0|2,1,0]=4 20 B18R3.12875 C1=CC2=C(C=C1)OC(=N2)NC3CCOCC3 Z646393492 [0,0,0,0,1,0|1,1,0]=3 21 B18R3.12875 C1=CC2=C(C=C1)SC(=N2)CN3CCCCC3 Z104557928 [0,0,0,0,1,0|2,0,0]=3 22 B18R3.12875 C1=CC2=C(C=C1)SC(=N2)CN3CCNCC3 Z56347552 [0,0,0,0,1,0|3,0,0]=4 23 B18R3.12875 C1=CC2=C(C=C1)SC(=N2)CN3CCOCC3 Z54748091 [0,0,0,0,1,0|3,0,0]=4 24 B18R3.12875 C1=CC2=C(C=C1)SC(=N2)NC3CCCCC3 Z55176260 [0,0,0,0,1,0|0,0,0]=1 25 B18R3.12875 C1=CC2=C(C=C1)SC(=N2)SN3CCOCC3 Z56821717 [0,0,0,0,1,0|2,0,0]=3 26 B20R3.30190 C1=CC2=C(C=C1)N=C(C=N2)NCC3CCCCC3 Z246173612 [0,0,0,0,0,1|3,0,0]=4 27 B20R3.30260 C1=CC2=C(C=C1)NC(=N2)N/N=C/C3CCCCC3 Z44868961 [0,0,0,0,0,1|2,0,1]=4 28 B20R3.30260 C1=CC2=C(C=C1)NC(=N2)SCCC3CCCCC3 Z111716114 [0,0,0,0,0,1|2,0,0]=3 29 B20R3.1869421 C1=CC2=C(C=C1)SC(=N2)NN=C3CCCCCC3 Z49559779 [0,0,0,0,0,1|1,0,2]=4 30 B17R2.2569 CCCCCCNC1=NC2=C(S1)C=CC=C2 Z56827488 [1,0,1,0,0,0|0,0,0]=2 31 B17R2.2569 CCOCCCNC1=NC2=C(S1)N=CC=C2 Z168882622 [1,0,1,0,0,0|2,0,0]=4 32 B17R2.2569 OCCOCCNC1=NC2=C(S1)C=CC=C2 Z86280921 [1,0,1,0,0,0|2,0,0]=4 33 B19R2.12592 CCC(C)CCCCNC1=NC2=C(S1)C=CC=C2 Z56827764 [0,1,1,0,0,0|2,0,0]=4 34 B19R2.13041 CCCCCCCCSC1=NC2=C(N1)C=CC=C2 Z57085685 [0,1,1,0,0,0|2,0,0]=4 35 B19R3.10823 CN(CC1=NC2=C(O1)C=CC=C2)C3CCCC3 Z169488436 [0,1,0,0,1,0|1,1,0]=4 36 B19R3.10823 O=C(NC1=NC2=C(S1)C=CC=C2)C3CCCC3 Z30199781 [0,1,0,0,1,0|2,0,0]=4 37 B19R3.54463 CC1CCCN(C1)CC2=NC3=C(S2)C=CC=C3 Z55001651 [0,1,0,0,1,0|2,0,0]=4 38 B19R3.54463 OC1CCCN(C1)CC2=NC3=C(S2)C=CC=C3 Z54749354 [0,1,0,0,1,0|2,0,0]=4 39 B19R3.88146 ClC1=CC2=C(C=C1)N=C(N2)SC3CCOCC3 Z1631878819 [0,1,0,0,1,0|2,0,0]=4 40 B19R3.88146 ClC1=CC2=C(C=C1)OC(=N2)SC3CCOCC3 Z1715479816 [0,1,0,0,1,0|1,1,0]=4 41 B19R3.88146 NC1=CC2=C(C=C1)NC(=N2)CC3CCCCC3 Z351735870 [0,1,0,0,1,0|2,0,0]=4 42 B19R3.171030 CC1CCCCC1NC2=NC3=C(N2)C=CC=C3 Z281062016 [0,1,0,0,1,0|1,0,0]=3 43 B19R3.171030 CC1CCCCC1NC2=NC3=C(O2)C=CC=C3 Z271215138 [0,1,0,0,1,0|0,1,0]=3 44 B19R3.171030 O=C1CCCCC1SC2=NC3=C(N2)C=CC=C3 Z53833336 [0,1,0,0,1,0|1,0,1]=4 45 B19R3.171030 O=C1CCCCC1SC2=NC3=C(O2)C=CC=C3 Z19652080 [0,1,0,0,1,0|0,1,1]=4 46 B19R3.171030 O=C1NCCCC1NC2=NC3=C(S2)C=CC=C3 Z929775950 [0,1,0,0,1,0|1,0,1]=4 47 B19R3.241821 CC1CCC(CC1)NC2=NC3=C(O2)C=CC=C3 Z271256170 [0,1,0,0,1,0|0,1,0]=3 48 B19R3.241821 OC1CCC(CC1)NC2=NC3=C(O2)C=CC=C3 Z244389936 [0,1,0,0,1,0|0,1,0]=3 49 B19R3.241821 OC1CCN(CC1)CC2=NC3=C(S2)C=CC=C3 Z54508295 [0,1,0,0,1,0|2,0,0]=4 50 B19R3.1799922 CN(C1=NC2=C(O1)C=CC=C2)C3CCCCC3 Z223779496 [0,1,0,0,1,0|0,1,0]=3 51 B21R3.24438 O=C(NC1CCCCC1)C2=NC3=C(C=CC=C3)C=C2 Z31484253 [0,1,0,0,0,1|2,0,0]=4 52 B21R3.24438 O=C(NC1CCCCC1)C2=NC3=C(C=CC=C3)N=C2 Z73229438 [0,1,0,0,0,1|2,0,0]=4 53 B21R3.24408 O=C(NCC1=NC2=C(S1)C=CC=C2)C3CCCCC3 Z28775499 [0,1,0,0,0,1|1,0,0]=3 54 B21R3.24408 O=C(OCC1=NC2=C(S1)C=CC=C2)C3CCCCC3 Z18266145 [0,1,0,0,0,1|1,1,0]=4 55 B21R3.154845 CC1=CC2=C(C=C1)NC(=N2)SCCC3CCCCC3 Z57298374 [0,1,0,0,0,1|2,0,0]=4 56 B21R3.154845 FC1=CC2=C(C=C1)N=C(S2)CNCC3CCCNC3 Z2354409737 [0,1,0,0,0,1|2,0,0]=4 57 B21R3.8338 CN1C(=NC2=C1C=CC=C2)CNC3CCCCC3O Z1154604197 [0,2,0,0,0,0|2,0,0]=4 58 B21R3.13071 C/C(=C\1/SC2=C(C1=O)C=CC=C2)/NC3CCCCC3 Z56792634 [0,2,0,0,0,0|2,0,0]=4 59 B21R3.13071 O=C(NC1CCCCC1)C2=C(C3=C(S2)C=CC=C3)Cl Z27759682 [0,2,0,0,0,0|2,0,0]=4 60 B21R3.154841 O=C(NC1=NC2=C(S1)C=C(C=C2)F)C3CCCCC3 Z27969882 [0,2,0,0,0,0|2,0,0]=4 61 B21R3.14886901 CN(C(=O)C1CCCCC1)C2=NC3=C(S2)C=CC=C3 Z238291286 [0,2,0,0,0,0|2,0,0]=4 62 B21R3.3957577 O=C(NC1CCCCC1O)C2=NC3=C(N2)C=CC=C3 Z1143373746 [0,2,0,0,0,0|2,0,0]=4 63 B21R3.393361 O=C(NC1CCCCC1)C2=CC3=C(C=CC=C3S2)F Z27759271 [0,2,0,0,0,0|2,0,0]=4 64 B21R3.659958 CC1CCC(CC1)NC(=O)C2=CC3=C(S2)C=CC=C3 Z87621741 [0,2,0,0,0,0|2,0,0]=4 65 B21R4.2261448 C1=CC2=C(C=C1)NC(=N2)C3CC4CCCCC4N3 Z234896645 [0,1,0,1,0,0|2,0,0]=4 66 B21R4.50839390 O=C(NC1CC2CC2C1)C3=NC4=C(S3)N=CC=C4 Z2382052678 [0,1,0,1,0,0|2,0,0]=4 67 B17R2.143 O=C(NC1=CC=CC=C1)NC2CCCCC2 Z44585885 [0,0,1,0,1,0|0,1,1]=4 68 B17R3.8708 C1=CC2=C(C=C1)NC(=N2)C3CCCCC3 Z50129880 [0,0,0,0,2,0|1,0,0]=3 69 B17R3.8708 C1=CC2=C(C=C1)NC(=N2)C3CCCCN3 Z283679094 [0,0,0,0,2,0|2,0,0]=4 70 B17R3.8708 C1=CC2=C(C=C1)NC(=N2)C3CCCNC3 Z220335562 [0,0,0,0,2,0|2,0,0]=4 71 B17R3.8708 C1=CC2=C(C=C1)NC(=N2)C3CCNCC3 Z220329114 [0,0,0,0,2,0|2,0,0]=4 72 B17R3.8708 C1=CC2=C(C=C1)OC(=N2)C3CCCCN3 Z119989956 [0,0,0,0,2,0|1,1,0]=4 73 B17R3.8708 C1=CC2=C(C=C1)OC(=N2)C3CCNCC3 Z55928836 [0,0,0,0,2,0|1,1,0]=4 74 B17R3.8708 C1=CC2=C(C=C1)SC(=N2)C3CCCCN3 Z104378240 [0,0,0,0,2,0|1,0,0]=3 75 B17R3.8708 C1=CC2=C(C=C1)SC(=N2)C3CCCNC3 Z56990718 [0,0,0,0,2,0|1,0,0]=3 76 B17R3.8708 C1=CC2=C(C=C1)SC(=N2)C3CCNCC3 Z56347136 [0,0,0,0,2,0|1,0,0]=3 77 B17R3.8708 C1=CC2=C(C=C1)SC(=N2)N3CCNCC3 Z381357674 [0,0,0,0,2,0|2,0,0]=4 78 B17R3.8708 C1=CC2=C(C=C1)SC(=N2)N3CCOCC3 Z56767623 [0,0,0,0,2,0|2,0,0]=4