0 B10R1.11 CCOC(=O)c1ccco1 CM10969 [0,1,0,0,0,0|2,0,1]=4 1 B10R2.7 c1c[nH]c2c1ccnc2 CM14075 [0,0,0,1,0,0|3,0,0]=4 2 B10R2.7 c1c[nH]c2c1cncc2 CM10258 [0,0,0,1,0,0|3,0,0]=4 3 B10R2.7 c1cc2c(cc[nH]2)nc1 CM14073 [0,0,0,1,0,0|2,0,0]=3 4 B10R2.7 c1cc2cc[nH]c2nc1 CM14215 [0,0,0,1,0,0|3,0,0]=4 5 B10R2.7 c1ccn2cccc2c1 CM10848 [0,0,0,1,0,0|2,0,0]=3 6 B7R1.1 c1c(nc[nH]1)C=O CM14068 [2,0,0,0,0,0|2,0,0]=4 7 B7R1.1 c1cc([nH]c1)C=O CM13861 [2,0,0,0,0,0|1,0,0]=3 8 B9R1.2 CNc1cccc(c1)O CM10115 [0,0,1,1,0,0|2,0,0]=4 9 B9R1.69 Cc1cc(ccc1F)O CM11763 [0,0,1,1,0,0|1,0,1]=4 10 B9R1.69 Cc1ccc(cc1Br)O CM10192 [0,0,1,1,0,0|2,0,0]=4 11 B9R1.69 Cc1ccc(cc1N)O CM11593 [0,0,1,1,0,0|2,0,0]=4 12 B9R1.69 Cc1ccc(cc1O)O CM10187 [0,0,1,1,0,0|2,0,0]=4 13 B9R1.69 c1cc(c(cc1O)Br)Cl CM11607 [0,0,1,1,0,0|2,0,0]=4 14 B9R1.69 c1cc(c(cc1O)Br)F CM11636 [0,0,1,1,0,0|2,0,0]=4 15 B9R1.69 c1cc(c(cc1O)Cl)Br CM10223 [0,0,1,1,0,0|2,0,0]=4 16 B9R1.69 c1cc(c(cc1O)Cl)I CM10112 [0,0,1,1,0,0|2,0,0]=4 17 B9R1.69 c1cc(c(cc1O)Cl)N CM11558 [0,0,1,1,0,0|2,0,0]=4 18 B9R1.69 c1cc(c(cc1O)Cl)N CM14377 [0,0,1,1,0,0|2,0,0]=4 19 B9R1.69 c1cc(c(cc1O)F)Br CM11641 [0,0,1,1,0,0|2,0,0]=4 20 B9R1.69 c1cc(c(cc1O)F)Cl CM10877 [0,0,1,1,0,0|2,0,0]=4 21 B9R1.69 c1cc(c(cc1O)F)F CM11728 [0,0,1,1,0,0|2,0,0]=4 22 B9R1.69 c1cc(c(cc1O)F)I CM10646 [0,0,1,1,0,0|2,0,0]=4 23 B9R1.69 c1cc(c(cc1O)F)N CM11581 [0,0,1,1,0,0|2,0,0]=4 24 B9R1.69 c1cc(c(cc1O)I)Cl CM11690 [0,0,1,1,0,0|2,0,0]=4 25 B9R1.69 c1cc(c(cc1O)N)F CM11577 [0,0,1,1,0,0|2,0,0]=4 26 B9R1.69 c1cc(c(cc1O)O)Br CM14332 [0,0,1,1,0,0|2,0,0]=4 27 B9R1.69 c1cc(c(cc1O)O)F CM11778 [0,0,1,1,0,0|2,0,0]=4 28 B9R1.69 c1cc(c(cc1O)O)N CM10297 [0,0,1,1,0,0|2,0,0]=4 29 B9R1.1 COc1ccc(cc1)F CM11749 [0,0,1,1,0,0|1,0,1]=4 30 B11R2.20 c1cc2c(cccn2)nc1 CM10135 [0,0,0,1,0,1|2,0,0]=4 31 B11R2.20 c1ccc2cnccc2c1 CM14380 [0,0,0,1,0,1|2,0,0]=4 32 B11R2.106 Cc1cccc2c1ccs2 CM10545 [0,1,0,1,0,0|1,1,0]=4 33 B11R2.106 Cc1cccc2c1occ2 CM10746 [0,1,0,1,0,0|1,0,0]=3 34 B11R2.106 c1c[nH]c2c1c(ccn2)Br CM14081 [0,1,0,1,0,0|2,0,0]=4 35 B11R2.106 c1c[nH]c2c1c(ccn2)Cl CM14082 [0,1,0,1,0,0|2,0,0]=4 36 B11R2.106 c1cc(c2c(c1)ocn2)N CM10312 [0,1,0,1,0,0|2,0,0]=4 37 B11R2.106 c1cc(c2ccoc2c1)O CM10739 [0,1,0,1,0,0|0,0,1]=3 38 B11R2.106 c1cc(c2ccsc2c1)F CM10724 [0,1,0,1,0,0|1,1,0]=4 39 B11R2.106 c1cc2c(cc[nH]2)c(c1)F CM13604 [0,1,0,1,0,0|2,0,0]=4 40 B11R2.106 c1cc2c(ccs2)c(c1)Br CM10723 [0,1,0,1,0,0|1,1,0]=4 41 B11R2.106 c1cc2cc[nH]c2c(c1)F CM13609 [0,1,0,1,0,0|2,0,0]=4 42 B11R2.106 c1cc2ccoc2c(c1)Br CM10530 [0,1,0,1,0,0|1,0,0]=3 43 B11R2.106 c1cc2ccoc2c(c1)Cl CM10751 [0,1,0,1,0,0|1,0,0]=3 44 B11R2.106 c1cc2ccoc2c(c1)F CM10752 [0,1,0,1,0,0|1,0,0]=3 45 B11R2.106 c1cnc(c2c1occ2)Cl CM14121 [0,1,0,1,0,0|1,0,0]=3 46 B11R2.106 c1csc2c1c(cnc2)Br CM10775 [0,1,0,1,0,0|1,1,0]=4 47 B11R2.36 Cc1ccc2c(c1)cco2 CM10745 [0,1,0,1,0,0|1,0,0]=3 48 B11R2.36 Cc1ccc2ccsc2c1 CM10722 [0,1,0,1,0,0|1,1,0]=4 49 B11R2.36 c1c[nH]c2c1ncc(c2)Br CM14253 [0,1,0,1,0,0|2,0,0]=4 50 B11R2.36 c1cc(cc2c1cc[nH]2)F CM13607 [0,1,0,1,0,0|2,0,0]=4 51 B11R2.36 c1cc(cc2c1cco2)Br CM10729 [0,1,0,1,0,0|1,0,0]=3 52 B11R2.36 c1cc(cc2c1cco2)O CM10757 [0,1,0,1,0,0|1,0,0]=3 53 B11R2.36 c1cc(cc2c1ccs2)Br CM10504 [0,1,0,1,0,0|1,1,0]=4 54 B11R2.36 c1cc2c(cc[nH]2)cc1F CM13606 [0,1,0,1,0,0|2,0,0]=4 55 B11R2.36 c1cc2c(cco2)cc1Br CM10728 [0,1,0,1,0,0|1,0,0]=3 56 B11R2.36 c1cc2c(cco2)cc1Cl CM10740 [0,1,0,1,0,0|1,0,0]=3 57 B11R2.36 c1cc2c(cco2)cc1F CM10741 [0,1,0,1,0,0|1,0,0]=3 58 B11R2.36 c1cc2c(ccs2)cc1Br CM10617 [0,1,0,1,0,0|1,1,0]=4