0 B8R1.8 CNCc1[nH]nnn1 A2Z00049550 [0,0,0,0,0,0|4,0,0]=4 1 B8R1.8 c1c([nH]cn1)CCN A2Z00050399 [0,0,0,0,0,0|0,0,0]=0 2 B8R1.8 c1c([nH]cn1)CCN A2Z00096061 [0,0,0,0,0,0|0,0,0]=0 3 B8R1.8 c1c(nc[nH]1)CCN A2Z00050200 [0,0,0,0,0,0|0,0,2]=2 4 B8R1.8 c1c(nc[nH]1)CCN A2Z00096418 [0,0,0,0,0,0|0,0,2]=2 5 B8R1.8 c1c(ncs1)CCN A2Z00049940 [0,0,0,0,0,0|1,0,1]=2 6 B8R1.8 c1cc(sc1)CCBr A2Z00096130 [0,0,0,0,0,0|3,0,0]=3 7 B8R1.8 c1cc(sc1)CCO A2Z00095929 [0,0,0,0,0,0|3,0,0]=3 8 B8R1.8 c1cn(cn1)CCN A2Z00087582 [0,0,0,0,0,0|2,0,0]=2 9 B8R1.8 c1cnn(c1)CCN A2Z00087581 [0,0,0,0,0,0|2,0,1]=3 10 B8R1.8 c1csc(n1)CCN A2Z00061620 [0,0,0,0,0,0|2,0,1]=3 11 B7R1.1 CCn1ccnc1 A2Z00097334 [1,0,0,0,0,0|2,0,0]=3 12 B7R1.1 CCn1cncn1 A2Z00096521 [1,0,0,0,0,0|1,0,1]=3 13 B7R1.1 c1cc([nH]c1)CN A2Z00061420 [1,0,0,0,0,0|1,0,0]=2 14 B7R1.1 c1cnoc1CO A2Z00096001 [1,0,0,0,0,0|3,0,0]=4 15 B7R1.1 c1csc(n1)CN A2Z00061547 [1,0,0,0,0,0|2,0,1]=4 16 B9R1.7 C(CBr)c1nnc(s1)N A2Z00068833 [0,1,0,0,0,0|3,0,0]=4 17 B9R1.7 C(CBr)c1nnc(s1)N A2Z00069976 [0,1,0,0,0,0|3,0,0]=4 18 B9R1.7 CCCc1nnc(s1)N A2Z00075883 [0,1,0,0,0,0|3,0,0]=4 19 B9R1.7 CCSc1[nH]c(nn1)N A2Z00070725 [0,1,0,0,0,0|3,0,0]=4 20 B9R1.7 Cc1[nH]cc(n1)CCN A2Z00047928 [0,1,0,0,0,0|0,0,2]=3 21 B9R1.7 Cc1cc(no1)CCN A2Z00047210 [0,1,0,0,0,0|2,0,1]=4 22 B9R1.7 Cc1cnc(o1)CCN A2Z00046155 [0,1,0,0,0,0|2,0,1]=4 23 B9R1.7 Cc1cnc(s1)CCN A2Z00061527 [0,1,0,0,0,0|2,0,1]=4 24 B9R1.7 Cc1csc(n1)CCN A2Z00061500 [0,1,0,0,0,0|2,0,1]=4 25 B9R1.7 Cc1csc(n1)CCN A2Z00083557 [0,1,0,0,0,0|2,0,1]=4 26 B9R1.7 Cc1nc(cs1)CCN A2Z00039139 [0,1,0,0,0,0|1,0,1]=3 27 B9R1.7 Cc1nc(cs1)CCN A2Z00083452 [0,1,0,0,0,0|1,0,1]=3 28 B9R1.7 Cc1nc(on1)CCN A2Z00094492 [0,1,0,0,0,0|1,0,1]=3 29 B9R1.7 Cn1cc(nc1)CCN A2Z00049691 [0,1,0,0,0,0|0,0,2]=3 30 B9R1.7 Cn1cc(nc1)CCN A2Z00096419 [0,1,0,0,0,0|0,0,2]=3 31 B9R1.11 c1cc(sc1)C(CN)O A2Z00046545 [0,1,0,0,0,0|2,0,0]=3 32 B9R1.12 CNCCc1c[nH]cn1 A2Z00049843 [0,1,0,0,0,0|0,0,2]=3 33 B9R1.12 CNCCc1cnc[nH]1 A2Z00049842 [0,1,0,0,0,0|0,0,0]=1 34 B9R1.12 c1cc(sc1)CCC#N A2Z00094590 [0,1,0,0,0,0|2,0,1]=4 35 B9R1.13 c1cc(sc1)CC(=O)N A2Z00095950 [0,1,0,0,0,0|2,0,1]=4 36 B9R1.33 Cc1nccn1CCN A2Z00087583 [0,1,0,0,0,0|2,0,0]=3 37 B9R1.33 Cn1cncc1CCN A2Z00095118 [0,1,0,0,0,0|0,0,0]=1 38 B9R1.33 c1[nH]c(c(n1)Br)CCN A2Z00095043 [0,1,0,0,0,0|0,0,0]=1 39 B9R1.33 c1cn(c(n1)Cl)CCO A2Z00050465 [0,1,0,0,0,0|3,0,0]=4 40 B9R1.8 c1ccc(cc1)CCBr A2Z00093579 [0,0,0,0,0,1|3,0,0]=4 41 B9R1.8 c1ccc(cc1)CCN A2Z00046190 [0,0,0,0,0,1|2,0,0]=3 42 B9R1.8 c1ccc(cc1)CNN A2Z00062153 [0,0,0,0,0,1|3,0,0]=4 43 B6R1.2 Cc1cscn1 A2Z00097343 [2,0,0,0,0,0|1,0,1]=4 44 B6R1.2 Cn1cncn1 A2Z00096073 [2,0,0,0,0,0|1,0,1]=4 45 B6R1.2 c1[nH]c(=S)[nH]n1 A2Z00016566 [2,0,0,0,0,0|2,0,0]=4 46 B6R1.2 c1c([nH]cn1)N A2Z00050362 [2,0,0,0,0,0|0,0,0]=2 47 B6R1.2 c1c([nH]nn1)N A2Z00096583 [2,0,0,0,0,0|1,0,0]=3 48 B6R1.2 c1c(n[nH]n1)N A2Z00096252 [2,0,0,0,0,0|1,0,1]=4 49 B6R1.2 c1cn[nH]c1N A2Z00050166 [2,0,0,0,0,0|2,0,0]=4 50 B6R1.2 c1nc([nH]n1)N A2Z00085533 [2,0,0,0,0,0|1,0,1]=4 51 B6R1.2 c1nc(sn1)N A2Z00095919 [2,0,0,0,0,0|1,0,1]=4 52 B8R1.1 CCc1cnc([nH]1)S A2Z00085583 [1,1,0,0,0,0|0,0,0]=2 53 B8R1.1 CCc1cnc(s1)N A2Z00085473 [1,1,0,0,0,0|1,0,0]=3 54 B8R1.1 CCc1csc(n1)N A2Z00085472 [1,1,0,0,0,0|1,0,1]=4 55 B8R1.1 Cc1nc(cs1)CN A2Z00073814 [1,1,0,0,0,0|1,0,1]=4 56 B8R1.1 Cc1nc(on1)CN A2Z00048852 [1,1,0,0,0,0|1,0,1]=4 57 B8R1.1 Cc1nnc(o1)CN A2Z00046143 [1,1,0,0,0,0|2,0,0]=4 58 B8R1.1 Cn1cc(cn1)CN A2Z00061673 [1,1,0,0,0,0|2,0,0]=4 59 B8R1.1 c1c([nH][nH]c1=O)CN A2Z00096246 [1,1,0,0,0,0|2,0,0]=4 60 B8R1.1 c1c([nH]nc1O)CN A2Z00096414 [1,1,0,0,0,0|2,0,0]=4 61 B8R1.7 CC(=O)c1cncs1 A2Z00085476 [1,1,0,0,0,0|1,0,1]=4 62 B8R1.7 CC(c1cccs1)O A2Z00094291 [1,1,0,0,0,0|2,0,0]=4 63 B8R1.11 Cn1c(nnn1)CN A2Z00070204 [1,1,0,0,0,0|2,0,0]=4 64 B8R1.11 Cn1ccnc1CN A2Z00061417 [1,1,0,0,0,0|2,0,0]=4 65 B10R1.1 c1cc(ccc1CCN)F A2Z00093996 [0,1,0,0,0,1|2,0,0]=4 66 B10R1.1 c1cc(ccc1CCN)O A2Z00038672 [0,1,0,0,0,1|2,0,0]=4 67 B10R1.4 c1ccc(c(c1)CCN)F A2Z00097645 [0,1,0,0,0,1|2,0,0]=4 68 B10R1.4 c1ccc(c(c1)CCN)O A2Z00049546 [0,1,0,0,0,1|2,0,0]=4 69 B10R1.10 Cc1cccc(c1)CCN A2Z00046191 [0,1,0,0,0,1|2,0,0]=4 70 B10R1.10 c1cc(cc(c1)Cl)CCN A2Z00093997 [0,1,0,0,0,1|2,0,0]=4 71 B10R1.15 CC(CN)c1ccccn1 A2Z00062148 [0,1,0,0,0,1|1,0,1]=4 72 B10R1.17 CNCCc1ccncc1 A2Z00061328 [0,1,0,0,0,1|1,0,0]=3 73 B10R1.17 c1cc(cnc1)CCCN A2Z00046192 [0,1,0,0,0,1|1,0,0]=3 74 B10R1.17 c1ccc(cc1)CCNN A2Z00095988 [0,1,0,0,0,1|2,0,0]=4 75 B10R1.17 c1ccc(cc1)CCNN A2Z00096724 [0,1,0,0,0,1|2,0,0]=4 76 B10R1.16 Cc1nc(on1)CCCN A2Z00048853 [0,2,0,0,0,0|1,0,1]=4 77 B10R1.94 CCCc1nnc(n1N)S A2Z00051970 [0,2,0,0,0,0|2,0,0]=4 78 B10R1.96 CCc1[nH]c(cn1)CCN A2Z00095039 [0,2,0,0,0,0|0,0,0]=2 79 B10R1.131 Cc1nc(cn1C)CCN A2Z00049690 [0,2,0,0,0,0|0,0,2]=4 80 B10R1.6 CC(C)(CN)c1ccco1 A2Z00061740 [0,2,0,0,0,0|2,0,0]=4 81 B10R1.6 CC(C)(CN)c1cccs1 A2Z00061738 [0,2,0,0,0,0|2,0,0]=4 82 B10R1.11 CNCC(c1cccs1)O A2Z00046548 [0,2,0,0,0,0|2,0,0]=4 83 B10R1.21 c1cc(oc1)CCCON A2Z00047946 [0,2,0,0,0,0|2,0,0]=4 84 B10R1.21 c1cn(cn1)CCCCN A2Z00061188 [0,2,0,0,0,0|2,0,0]=4 85 B10R1.29 c1nnc(n1N)SCCO A2Z00017244 [0,2,0,0,0,0|2,0,0]=4 86 B10R1.66 c1cc([nH]c1)CCC(=O)O A2Z00094982 [0,2,0,0,0,0|2,0,0]=4 87 B8R1.2 c1cc(cnc1)CN A2Z00093433 [0,0,1,1,0,0|1,0,1]=4 88 B10R2.6 c1ccc(cc1)C2CN2 A2Z00049782 [0,0,0,1,0,1|2,0,0]=4 89 B10R2.2 C1Cc2c(sc(n2)N)C1 A2Z00098259 [0,1,0,1,0,0|2,0,0]=4