0 B8R1.8 CCSc1[nH]nnn1 BC205670 [0,0,0,0,0,0|4,0,0]=4 1 B8R1.8 c1c(nc[nH]1)CCCl BC206376 [0,0,0,0,0,0|1,0,2]=3 2 B8R1.8 c1c(nc[nH]1)CCN BC205752 [0,0,0,0,0,0|0,0,2]=2 3 B8R1.8 c1c(nc[nH]1)CCN BC206197 [0,0,0,0,0,0|0,0,2]=2 4 B8R1.8 c1c(nc[nH]1)CCO BC678874 [0,0,0,0,0,0|1,0,2]=3 5 B8R1.8 c1ncn(n1)CCN BC685962 [0,0,0,0,0,0|1,0,1]=2 6 B7R1.1 C(c1[nH]nnn1)Cl BC211191 [1,0,0,0,0,0|3,0,0]=4 7 B7R1.1 CCc1cccs1 BC210545 [1,0,0,0,0,0|2,0,0]=3 8 B7R1.1 CCn1cncn1 BC207618 [1,0,0,0,0,0|1,0,1]=3 9 B7R1.1 CSc1[nH]ccn1 BC600114 [1,0,0,0,0,0|3,0,0]=4 10 B7R1.1 c1c([nH]nn1)S[Na] BC214852 [1,0,0,0,0,0|3,0,0]=4 11 B7R1.1 c1c(ncs1)CBr BC658988 [1,0,0,0,0,0|2,0,1]=4 12 B7R1.1 c1c(scn1)C=O BC678913 [1,0,0,0,0,0|2,0,1]=4 13 B7R1.1 c1c(scn1)CO BC200640 [1,0,0,0,0,0|2,0,0]=3 14 B7R1.1 c1cc([nH]c1)C=O BC210794 [1,0,0,0,0,0|2,0,1]=4 15 B7R1.1 c1cc([nH]c1)CN BC620340 [1,0,0,0,0,0|1,0,0]=2 16 B7R1.1 c1cnc([nH]1)CO BC212206 [1,0,0,0,0,0|3,0,0]=4 17 B7R1.1 c1cscc1CN BC655305 [1,0,0,0,0,0|2,0,0]=3 18 B9R1.12 CCCCc1[nH]ccn1 BC222416 [0,1,0,0,0,0|3,0,0]=4 19 B9R1.33 Cc1c(scn1)CCO BC200852 [0,1,0,0,0,0|2,0,0]=3 20 B9R1.33 Cn1cncc1N=C=O BC295518 [0,1,0,0,0,0|2,0,1]=4 21 B9R1.8 C1CCC(=CC1)CCN BC209653 [0,0,0,0,0,1|2,0,1]=4 22 B9R1.8 c1c(cncn1)CC#N BC678765 [0,0,0,0,0,1|0,0,3]=4 23 B9R1.8 c1cc(cnc1)CCN BC226643 [0,0,0,0,0,1|1,0,0]=2 24 B9R1.8 c1ccc(cc1)CCBr BC203736 [0,0,0,0,0,1|3,0,0]=4 25 B9R1.8 c1ccc(cc1)CCO BC213746 [0,0,0,0,0,1|3,0,0]=4 26 B9R1.8 c1ccc(cc1)CNN BC652179 [0,0,0,0,0,1|3,0,0]=4 27 B9R1.8 c1ccc(cc1)CNN BC676720 [0,0,0,0,0,1|3,0,0]=4 28 B9R1.8 c1ccnc(c1)CCBr BC216605 [0,0,0,0,0,1|2,0,1]=4 29 B9R1.8 c1cnccc1CCBr BC683652 [0,0,0,0,0,1|2,0,0]=3 30 B9R1.8 c1cnccc1CCO BC201212 [0,0,0,0,0,1|2,0,0]=3 31 B6R0.6 CCC\C=C\C=O BC231929 [1,0,1,0,0,0|2,0,0]=4 32 B6R1.2 Cc1[nH]ccn1 BC228979 [2,0,0,0,0,0|2,0,0]=4 33 B6R1.2 Cc1c[nH]cn1 BC200416 [2,0,0,0,0,0|0,0,2]=4 34 B6R1.2 Cc1c[nH]nc1 BC677698 [2,0,0,0,0,0|2,0,0]=4 35 B6R1.2 Cc1ccno1 BC226936 [2,0,0,0,0,0|2,0,0]=4 36 B6R1.2 Cn1ccnc1 BC680917 [2,0,0,0,0,0|2,0,0]=4 37 B6R1.2 Cn1cncn1 BC207617 [2,0,0,0,0,0|1,0,1]=4 38 B6R1.2 c1c([nH]cn1)Cl BC220087 [2,0,0,0,0,0|1,0,0]=3 39 B6R1.2 c1c(nc[nH]1)N BC686543 [2,0,0,0,0,0|0,0,2]=4 40 B6R1.2 c1c(ncs1)N BC264749 [2,0,0,0,0,0|1,0,1]=4 41 B6R1.2 c1c(scn1)Br BC222081 [2,0,0,0,0,0|2,0,0]=4 42 B6R1.2 c1c(scn1)N BC225246 [2,0,0,0,0,0|1,0,0]=3 43 B6R1.2 c1c(snn1)N BC210162 [2,0,0,0,0,0|2,0,0]=4 44 B6R1.2 c1cnc([nH]1)N BC220007 [2,0,0,0,0,0|2,0,0]=4 45 B6R1.2 c1cnc([nH]1)N BC678011 [2,0,0,0,0,0|2,0,0]=4 46 B6R1.2 c1cscc1N BC677154 [2,0,0,0,0,0|2,0,0]=4 47 B6R1.2 c1cscc1N BC686803 [2,0,0,0,0,0|2,0,0]=4 48 B8R1.1 CCc1[nH]cc(n1)Br BC220073 [1,1,0,0,0,0|2,0,0]=4 49 B8R1.1 c1c(sc(n1)Cl)CCl BC209499 [1,1,0,0,0,0|2,0,0]=4 50 B8R1.1 c1c(sc(n1)Cl)CN BC201455 [1,1,0,0,0,0|1,0,0]=3 51 B8R1.1 c1c(sc(n1)N)CO BC658236 [1,1,0,0,0,0|2,0,0]=4 52 B8R1.7 CC(C)n1ccnc1 BC222412 [1,1,0,0,0,0|2,0,0]=4 53 B8R1.7 c1c([nH]cn1)C(=O)O BC223837 [1,1,0,0,0,0|1,0,1]=4 54 B8R1.7 c1c([nH]cn1)[N+](=O)[O-] BC212522 [1,1,0,0,0,0|2,0,0]=4 55 B8R1.11 CCc1c[nH]nc1N BC245606 [1,1,0,0,0,0|2,0,0]=4 56 B8R1.11 Cc1c([nH]cn1)CO BC216404 [1,1,0,0,0,0|1,0,0]=3 57 B8R1.11 Cn1c(ccn1)CN BC273639 [1,1,0,0,0,0|2,0,0]=4 58 B10R1.1 c1cc(ccc1CCN)Br BC205235 [0,1,0,0,0,1|2,0,0]=4 59 B10R1.4 c1ccc(c(c1)CCN)Br BC202041 [0,1,0,0,0,1|2,0,0]=4 60 B10R1.10 c1cc(cc(c1)O)CCN BC600077 [0,1,0,0,0,1|2,0,0]=4 61 B10R1.17 CNCCc1ccccn1 BC218953 [0,1,0,0,0,1|1,0,1]=4 62 B10R1.17 c1cnccc1CCCO BC222234 [0,1,0,0,0,1|2,0,0]=4 63 B10R1.66 c1c([nH]cn1)CCC(=O)O BC244534 [0,2,0,0,0,0|1,0,0]=3 64 B8R1.2 c1cc(cnc1)CN BC205833 [0,0,1,1,0,0|1,0,1]=4 65 B8R1.5 c1cc(c(nc1)N)N BC227150 [0,0,1,1,0,0|0,0,2]=4 66 B8R1.4 c1c(cncc1N)N BC227073 [0,0,1,1,0,0|0,0,2]=4 67 B10R2.7 c1ccc2c(c1)CCN2 BC219733 [0,0,0,1,0,1|2,0,0]=4