0 B12R1.286 CCOc1ccc(c(c1)OC)Br DA-29616 [0,0,0,0,0,0|2,0,1]=3 1 B12R1.286 CCc1cc(ccc1N)OCC DA-39466 [0,0,0,0,0,0|3,0,1]=4 2 B11R1.192 CCCc1ccc(c(c1)Cl)O DA-26541 [1,0,0,0,0,0|1,0,2]=4 3 B11R1.192 CCOc1ccc(c(c1)Br)O DA-26850 [1,0,0,0,0,0|2,0,1]=4 4 B11R1.192 CCOc1ccc(c(c1)Cl)O DA-26576 [1,0,0,0,0,0|2,0,1]=4 5 B11R1.192 COCc1ccc(c(c1)Cl)O DA-26603 [1,0,0,0,0,0|2,0,1]=4 6 B11R1.192 Cc1cc(ccc1O)CCO DA-28168 [1,0,0,0,0,0|1,0,2]=4 7 B11R1.192 c1cc(c(cc1C=NO)F)O DA-23606 [1,0,0,0,0,0|3,0,0]=4 8 B11R1.280 CCc1cc(ccc1Br)OC DA-29681 [1,0,0,0,0,0|3,0,0]=4 9 B11R1.280 CCc1cc(ccc1N)OC DA-26241 [1,0,0,0,0,0|3,0,0]=4 10 B11R1.280 CCc1cc(ccc1O)C=O DA-23637 [1,0,0,0,0,0|2,0,0]=3 11 B11R1.280 CCc1cc(ccc1O)CO DA-23636 [1,0,0,0,0,0|2,0,1]=4 12 B11R1.280 CCc1ccc(c(c1)C#N)O DA-37391 [1,0,0,0,0,0|2,0,1]=4 13 B11R1.280 COc1c(ccc(n1)C=O)Cl DA-47174 [1,0,0,0,0,0|3,0,0]=4 14 B11R1.280 COc1cc(ccc1Br)CBr DA-29640 [1,0,0,0,0,0|2,0,1]=4 15 B11R1.280 COc1cc(ccc1Cl)CN DA-31949 [1,0,0,0,0,0|2,0,1]=4 16 B11R1.280 COc1cc(ccc1Cl)NN DA-31950 [1,0,0,0,0,0|3,0,0]=4 17 B11R1.280 COc1cc(ccc1N)C#N DA-21349 [1,0,0,0,0,0|2,0,1]=4 18 B11R1.280 Cc1ccc(nc1OC)C=O DA-46974 [1,0,0,0,0,0|3,0,0]=4 19 B13R1.49 CCc1cc(ccc1N)C(=O)OC DA-32511 [0,1,0,0,0,0|3,0,0]=4 20 B13R1.49 COc1cc(ccc1Cl)C(=O)OC DA-32473 [0,1,0,0,0,0|2,0,0]=3 21 B13R1.52 CC(C)Nc1ccc(c(c1)OC)N DA-40944 [0,1,0,0,0,0|2,0,1]=4 22 B13R1.52 CC(C)Oc1ccc(c(c1)OC)Br DA-29612 [0,1,0,0,0,0|2,0,1]=4 23 B13R1.52 CN(C)Cc1ccc(c(c1)OC)N DA-21779 [0,1,0,0,0,0|2,0,1]=4 24 B13R1.52 CN(C)Cc1ccc(c(c1)OC)O DA-21778 [0,1,0,0,0,0|1,0,1]=3 25 B13R1.384 CCCc1ccc(c(c1)CCC)O DA-27254 [0,1,0,0,0,0|1,0,2]=4 26 B13R1.386 COc1ccc(cc1OC)CCCl DA-22855 [0,1,0,0,0,0|1,0,2]=4 27 B13R1.575 CCCOc1ccc(c(c1)OC)Br DA-29675 [0,1,0,0,0,0|1,0,2]=4 28 B13R1.575 COc1cc(ccc1O)CN=C=O DA-22186 [0,1,0,0,0,0|1,0,2]=4 29 B13R2.599 COc1cc2c(cc1Cl)CNC2 DA-37467 [0,0,0,1,0,0|2,0,1]=4 30 B13R2.599 Cc1cc2c(cc[nH]2)cc1OC DA-37186 [0,0,0,1,0,0|2,0,0]=3 31 B10R1.10 C=CCc1cccc(c1)O DA-24348 [2,0,0,0,0,0|0,0,2]=4 32 B10R1.176 C=Cc1ccc(c(c1)F)Cl DA-29552 [2,0,0,0,0,0|2,0,0]=4 33 B10R1.176 CCc1ccc(c(c1)Br)O DA-41824 [2,0,0,0,0,0|1,0,1]=4 34 B10R1.176 Cc1cc(ccc1O)CN DA-22359 [2,0,0,0,0,0|1,0,1]=4 35 B10R1.30 CCc1cc(ccc1O)Br DA-39939 [2,0,0,0,0,0|2,0,0]=4 36 B10R1.30 COc1c(ccc(n1)I)O DA-46210 [2,0,0,0,0,0|2,0,0]=4 37 B10R1.30 Cc1ccc(c(c1)NC)N DA-46240 [2,0,0,0,0,0|2,0,0]=4 38 B10R1.30 Cc1ccc(c(n1)OC)Cl DA-23848 [2,0,0,0,0,0|2,0,0]=4 39 B12R1.270 CCNc1cc(ccc1N)OC DA-46138 [1,1,0,0,0,0|1,0,1]=4 40 B12R1.382 CNCCc1cccc(c1)OC DA-28419 [1,1,0,0,0,0|0,0,2]=4 41 B12R1.435 CCc1cccc(c1)C(=O)OC DA-32691 [1,1,0,0,0,0|2,0,0]=4 42 B12R1.435 CNc1cccc(c1)C(=O)OC DA-32817 [1,1,0,0,0,0|2,0,0]=4 43 B12R1.438 CC(=C)Cc1cccc(c1)SC DA-31348 [1,1,0,0,0,0|0,1,1]=4 44 B12R1.438 CC(Cc1cccc(c1)OC)Br DA-31443 [1,1,0,0,0,0|0,0,2]=4 45 B12R1.438 CC(Cc1cccc(c1)OC)O DA-31166 [1,1,0,0,0,0|0,0,2]=4 46 B12R1.367 CNC(=O)c1ccc(c(c1)Br)O DA-24015 [1,1,0,0,0,0|2,0,0]=4 47 B12R1.367 Cc1cc(ccc1N)C(=O)NC DA-40468 [1,1,0,0,0,0|2,0,0]=4 48 B12R1.385 CCCCc1ccc(c(c1)C)O DA-39784 [1,1,0,0,0,0|0,0,2]=4 49 B12R1.56 CC(=O)c1ccc(c(c1)OC)Br DA-31071 [1,1,0,0,0,0|1,0,0]=3 50 B12R1.56 COc1cc(ccc1I)C(=O)N DA-39304 [1,1,0,0,0,0|2,0,0]=4 51 B12R1.56 COc1cc(ccc1I)C(=O)O DA-39303 [1,1,0,0,0,0|2,0,0]=4 52 B12R1.449 COc1cc(c(cc1Br)F)C=O DA-39938 [1,1,0,0,0,0|2,0,0]=4 53 B12R1.449 COc1cc(c(cc1F)Br)C=O DA-26845 [1,1,0,0,0,0|2,0,0]=4 54 B12R1.449 COc1cc(c(cc1F)F)C=O DA-27282 [1,1,0,0,0,0|2,0,0]=4 55 B12R1.449 Cc1cc(c(cc1SC)OC)O DA-25993 [1,1,0,0,0,0|1,0,0]=3 56 B12R1.654 CCc1c(ccc(c1O)C=O)O DA-23648 [1,1,0,0,0,0|2,0,0]=4 57 B12R1.654 COc1c(ccc(c1Cl)C=O)F DA-26573 [1,1,0,0,0,0|2,0,0]=4 58 B14R1.41 CC(C(c1ccc(c(c1)OC)O)O)O DA-30980 [0,2,0,0,0,0|0,0,2]=4 59 B14R1.41 CN(C)C(=O)c1ccc(c(c1)OC)N DA-21267 [0,2,0,0,0,0|2,0,0]=4 60 B14R1.436 CCCc1cc(ccc1O)C(=O)CC DA-30979 [0,2,0,0,0,0|1,0,1]=4 61 B14R1.626 CCOC(=O)c1ccc(c(c1)OC)I DA-33870 [0,2,0,0,0,0|1,0,1]=4 62 B14R1.1864 COc1cc(ccc1CO)C(=O)OC DA-32552 [0,2,0,0,0,0|1,0,0]=3 63 B14R1.2283 COc1cc(c(cc1Cl)N)C(=O)OC DA-33042 [0,2,0,0,0,0|2,0,0]=4 64 B14R1.2283 COc1cc(c(cc1F)Br)C(=O)OC DA-48410 [0,2,0,0,0,0|2,0,0]=4 65 B14R1.881 Cc1cc(c(cc1NC(=O)C)OC)Br DA-41024 [0,2,0,0,0,0|2,0,0]=4 66 B14R1.3405 COc1cc(ccc1O)CC(CO)O DA-25168 [0,2,0,0,0,0|0,0,2]=4 67 B12R2.44 CCc1ccc2c(c1)ccs2 DA-37376 [1,0,0,1,0,0|2,0,0]=4 68 B12R2.82 Cc1c(ccc2c1[nH]cc2)Br DA-36410 [1,0,0,1,0,0|2,0,0]=4 69 B12R2.100 Cc1cc2cc[nH]c2cc1N DA-37156 [1,0,0,1,0,0|2,0,0]=4 70 B14R2.37948 CC=C1c2cc(c(cc2O1)O)OC DA-39473 [0,1,0,1,0,0|0,0,0]=2 71 B14R2.1128 COc1cc2ccccc2cc1Br DA-26892 [0,1,0,1,0,0|1,0,1]=4 72 B14R2.1128 COc1cc2cccnc2cc1Br DA-35753 [0,1,0,1,0,0|1,0,1]=4 73 B14R2.1128 COc1cc2ccncc2cc1Br DA-35754 [0,1,0,1,0,0|1,0,1]=4 74 B14R2.1128 Cc1cc2cccnc2cc1OC DA-35605 [0,1,0,1,0,0|1,0,1]=4