0 B22R3.15512255 C=C(C#N)COc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100000694840 [0,0,0,0,0,0|3,0,0]=3 1 B22R3.15512255 C=CC(O)COc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100000730141 [0,0,0,0,0,0|1,0,3]=4 2 B22R3.15512255 CCC(=O)CNc1cccc2c1cc3c(c2)cccc3 7a_100000033484_100000747405 [0,0,0,0,0,0|4,0,0]=4 3 B22R3.15512255 CCC(=O)CSc1cccc2c1cc3c(c2)cccc3 62a_100000747405_100010188719 [0,0,0,0,0,0|3,1,0]=4 4 B22R3.15512255 CCC(C)CNc1cccc2c1nc3c(n2)cccc3 27a_100020588543_100010275551 [0,0,0,0,0,0|3,0,1]=4 5 B22R3.15512255 CCC(C)COc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100000748023 [0,0,0,0,0,0|2,0,1]=3 6 B22R3.15512255 CCC(O)CNc1cccc2c1nc3c(n2)cccc3 27a_100011218483_100010275551 [0,0,0,0,0,0|2,0,2]=4 7 B22R3.15512255 CCC(O)COc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100011218378 [0,0,0,0,0,0|1,0,2]=3 8 B22R3.15512255 CC[C@H](C)COc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100009816398 [0,0,0,0,0,0|2,0,1]=3 9 B22R3.15512255 CNC(=O)CNc1cccc2c1cc3c(c2)cccc3 34a_100000033484_100000183359 [0,0,0,0,0,0|4,0,0]=4 10 B22R3.15512255 CNC(=O)CNc1cccc2c1cc3c(c2)cccc3 7a_100000033484_100000183359 [0,0,0,0,0,0|4,0,0]=4 11 B22R3.15512255 CNC(=O)CNc1cccc2c1nc3c(c2)cccc3 34a_200000072084_100000183359 [0,0,0,0,0,0|3,0,0]=3 12 B22R3.15512255 CNC(=O)CNc1cccc2c1nc3c(n2)cccc3 27a_100000693194_100010275551 [0,0,0,0,0,0|2,0,0]=2 13 B22R3.15512255 CNC(=O)COc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100000183359 [0,0,0,0,0,0|1,0,0]=1 14 B22R3.15512255 CNC(=O)CSc1cccc2c1cc3c(c2)cccc3 62a_100000183359_100010188719 [0,0,0,0,0,0|3,1,0]=4 15 B22R3.15512255 COC(=O)CNc1cccc2c1cc3c(c2)cccc3 34a_100000033484_100000747449 [0,0,0,0,0,0|3,0,0]=3 16 B22R3.15512255 COC(=O)CNc1cccc2c1cc3c(c2)cccc3 7a_100000033484_100000747449 [0,0,0,0,0,0|3,0,0]=3 17 B22R3.15512255 COC(=O)CNc1cccc2c1nc3c(c2)cccc3 34a_200000072084_100000747449 [0,0,0,0,0,0|2,0,0]=2 18 B22R3.15512255 COC(=O)COc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100000747449 [0,0,0,0,0,0|0,0,0]=0 19 B22R3.15512255 COC(=O)CSc1cccc2c1cc3c(c2)cccc3 62a_100000747449_100010188719 [0,0,0,0,0,0|2,1,0]=3 20 B22R3.15512255 CO[C@H](C)CNc1cccc2c1nc3c(n2)cccc3 27a_100020591295_100010275551 [0,0,0,0,0,0|2,0,1]=3 21 B22R3.15512255 C[C@@H](CO)COc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100000059175 [0,0,0,0,0,0|3,0,1]=4 22 B22R3.15512255 OCC(O)COc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100011219619 [0,0,0,0,0,0|2,0,2]=4 23 B22R3.15512255 OC[C@H](O)COc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100009815848 [0,0,0,0,0,0|2,0,2]=4 24 B22R3.15512255 O[C@@H](CF)COc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100015614560 [0,0,0,0,0,0|2,0,2]=4 25 B21R3.2461284 C#CCCOc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100000688953 [1,0,0,0,0,0|1,0,2]=4 26 B21R3.2461284 C/C=C/CNc1cccc2c1nc3c(c2)cccc3 34a_200000072084_100102629194 [1,0,0,0,0,0|3,0,0]=4 27 B21R3.2461284 C/C=C/COc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100102629194 [1,0,0,0,0,0|1,0,0]=2 28 B21R3.2461284 C=CCCOc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100000754431 [1,0,0,0,0,0|1,0,2]=4 29 B21R3.2461284 CC#CCNc1cccc2c1nc3c(n2)cccc3 27a_100000685387_100010275551 [1,0,0,0,0,0|2,0,1]=4 30 B21R3.2461284 CC#CCOc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100000748600 [1,0,0,0,0,0|1,0,1]=3 31 B21R3.2461284 CC=CCNc1cccc2c1nc3c(c2)cccc3 34a_200000072084_100000070051 [1,0,0,0,0,0|3,0,0]=4 32 B21R3.2461284 CC=CCOc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100000070051 [1,0,0,0,0,0|1,0,0]=2 33 B21R3.2461284 CCCCNc1cccc2c1nc3c(n2)cccc3 27a_100000102301_100010275551 [1,0,0,0,0,0|2,0,1]=4 34 B21R3.2461284 CCCCOc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100000210210 [1,0,0,0,0,0|1,0,1]=3 35 B21R3.2461284 COCC=Cc1cccc2c1nc3c(n2)cccc3 271570a_100016286323_100010275551 [1,0,0,0,0,0|1,0,2]=4 36 B21R3.2461284 COCCNc1cccc2c1nc3c(c2)cccc3 34a_200000072084_100011201679 [1,0,0,0,0,0|2,0,1]=4 37 B21R3.2461284 COCCNc1cccc2c1nc3c(n2)cccc3 27a_100000209980_100010275551 [1,0,0,0,0,0|1,0,1]=3 38 B21R3.2461284 COCCOc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100011201679 [1,0,0,0,0,0|0,0,1]=2 39 B21R3.2461284 CSCCNc1cccc2c1nc3c(n2)cccc3 27a_100020590264_100010275551 [1,0,0,0,0,0|1,1,1]=4 40 B21R3.2461284 CSCCOc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100000212216 [1,0,0,0,0,0|0,1,1]=3 41 B21R3.2461284 FCCCOc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100011934791 [1,0,0,0,0,0|2,0,1]=4 42 B21R3.2461284 OCCCOc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100000230001 [1,0,0,0,0,0|2,0,1]=4 43 B21R3.9903402 C=C(C)CNc1cccc2c1nc3c(c2)cccc3 34a_200000072084_100000748629 [1,0,0,0,0,0|3,0,0]=4 44 B21R3.9903402 C=C(C)CNc1cccc2c1nc3c(n2)cccc3 27a_100000765925_100010275551 [1,0,0,0,0,0|2,0,0]=3 45 B21R3.9903402 C=C(C)COc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100000748629 [1,0,0,0,0,0|1,0,0]=2 46 B21R3.9903402 C=C(F)COc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100009893438 [1,0,0,0,0,0|1,0,1]=3 47 B21R3.9903402 CC(C)CNc1cccc2c1nc3c(n2)cccc3 27a_100000210953_100010275551 [1,0,0,0,0,0|2,0,1]=4 48 B21R3.9903402 CC(C)COc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100000210624 [1,0,0,0,0,0|1,0,1]=3 49 B21R3.9903402 CC(O)CNc1cccc2c1nc3c(n2)cccc3 27a_100000210904_100010275551 [1,0,0,0,0,0|1,0,2]=4 50 B21R3.9903402 CC(O)COc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100011218427 [1,0,0,0,0,0|0,0,2]=3 51 B21R3.9903402 C[C@@H](O)COc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100009817552 [1,0,0,0,0,0|0,0,2]=3 52 B21R3.9903402 FC(F)COc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100011934356 [1,0,0,0,0,0|2,0,1]=4 53 B21R3.9903402 NC(=O)CNc1cccc2c1nc3c(c2)cccc3 34a_200000072084_100000187820 [1,0,0,0,0,0|3,0,0]=4 54 B21R3.9903402 NC(=O)COc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100000187820 [1,0,0,0,0,0|1,0,0]=2 55 B21R3.9903402 O=C([O-])CNc1cccc2c1nc3c(c2)cccc3 34a_200000072084_100020667443 [1,0,0,0,0,0|2,0,1]=4 56 B21R3.9903402 O=C([O-])COc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100020667443 [1,0,0,0,0,0|0,0,1]=2 57 B21R3.9903402 O=[N+]([O-])COc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100000761209 [1,0,0,0,0,0|1,0,1]=3 58 B23R3.1355091 CNC(=O)CNc1cccc2c1nc3c(n2)cc(cc3)Cl 27a_100000693194_100160470743 [0,1,0,0,0,0|2,0,0]=3 59 B23R3.1355091 CO[C@H](C)CNc1cccc2c1nc3c(n2)cc(cc3)Cl 27a_100020591295_100160470743 [0,1,0,0,0,0|2,0,1]=4 60 B23R3.2412497 C=COC(=O)CNc1cccc2c1nc3c(c2)cccc3 34a_200000072084_100000036128 [0,1,0,0,0,0|2,0,1]=4 61 B23R3.2412497 C=COC(=O)COc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100000036128 [0,1,0,0,0,0|0,0,1]=2 62 B23R3.2412497 CCCC(C)COc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100011216630 [0,1,0,0,0,0|2,0,1]=4 63 B23R3.2412497 CCNC(=O)CNc1cccc2c1nc3c(c2)cccc3 34a_200000072084_100000183381 [0,1,0,0,0,0|3,0,0]=4 64 B23R3.2412497 CCNC(=O)CNc1cccc2c1nc3c(n2)cccc3 27a_100016988866_100010275551 [0,1,0,0,0,0|2,0,0]=3 65 B23R3.2412497 CCNC(=O)COc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100000183381 [0,1,0,0,0,0|1,0,0]=2 66 B23R3.2412497 CCOC(=O)C=Cc1cccc2c1nc3c(n2)cccc3 271570a_100010199719_100010275551 [0,1,0,0,0,0|1,0,1]=3 67 B23R3.2412497 CCOC(=O)CNc1cccc2c1cc3c(c2)cccc3 34a_100000033484_100000188475 [0,1,0,0,0,0|3,0,0]=4 68 B23R3.2412497 CCOC(=O)CNc1cccc2c1cc3c(c2)cccc3 7a_100000033484_100000188475 [0,1,0,0,0,0|3,0,0]=4 69 B23R3.2412497 CCOC(=O)CNc1cccc2c1nc3c(c2)cccc3 34a_200000072084_100000188475 [0,1,0,0,0,0|2,0,0]=3 70 B23R3.2412497 CCOC(=O)COc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100000188475 [0,1,0,0,0,0|0,0,0]=1 71 B23R3.2412497 CCOC(=O)CSc1cccc2c1cc3c(c2)cccc3 62a_100000188475_100010188719 [0,1,0,0,0,0|2,1,0]=4 72 B23R3.2412497 COCC(O)CNc1cccc2c1nc3c(n2)cccc3 27a_100000756049_100010275551 [0,1,0,0,0,0|1,0,2]=4 73 B23R3.2412497 COCC(O)COc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100011215053 [0,1,0,0,0,0|0,0,2]=3 74 B23R3.2412497 O=C(CNc1cccc2c1nc3c(c2)cccc3)NCO 34a_200000072084_100000185155 [0,1,0,0,0,0|3,0,0]=4 75 B23R3.2412497 O=C(COc1cccc2c1nc3c(n2)cccc3)NCO 34a_100000029702_100000185155 [0,1,0,0,0,0|1,0,0]=2 76 B23R3.2804070 CNC(=O)C(=O)Nc1cccc2c1nc3c(n2)cccc3 1626a_100000029703_100011218921 [0,1,0,0,0,0|2,0,1]=4 77 B23R3.2804070 CNC(=O)C(C)Nc1cccc2c1nc3c(c2)cccc3 34a_200000072084_100000731044 [0,1,0,0,0,0|3,0,0]=4 78 B23R3.2804070 CNC(=O)C(C)Oc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100000731044 [0,1,0,0,0,0|1,0,0]=2 79 B23R3.2804070 CNC(=O)C(F)Nc1cccc2c1nc3c(c2)cccc3 34a_200000072084_100009813575 [0,1,0,0,0,0|3,0,0]=4 80 B23R3.2804070 CNC(=O)C(F)Oc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100009813575 [0,1,0,0,0,0|1,0,0]=2 81 B23R3.2804070 CNC(=O)[C@@H](C)Nc1cccc2c1nc3c(n2)cccc3 27a_100000684985_100010275551 [0,1,0,0,0,0|2,0,0]=3 82 B23R3.2804070 COC(=O)C(=O)Nc1cccc2c1nc3c(c2)cccc3 11a_200000072084_100000024059 [0,1,0,0,0,0|2,0,1]=4 83 B23R3.2804070 COC(=O)C(=O)Nc1cccc2c1nc3c(c2)cccc3 1626a_200000072084_100000024059 [0,1,0,0,0,0|2,0,1]=4 84 B23R3.2804070 COC(=O)C(=O)Nc1cccc2c1nc3c(c2)cccc3 527a_200000072084_100000024059 [0,1,0,0,0,0|2,0,1]=4 85 B23R3.2804070 COC(=O)C(=O)Nc1cccc2c1nc3c(n2)cccc3 11a_100000029703_100000024059 [0,1,0,0,0,0|1,0,1]=3 86 B23R3.2804070 COC(=O)C(=O)Nc1cccc2c1nc3c(n2)cccc3 1626a_100000029703_100000024059 [0,1,0,0,0,0|1,0,1]=3 87 B23R3.2804070 COC(=O)C(C)Nc1cccc2c1cc3c(c2)cccc3 34a_100000033484_100000211248 [0,1,0,0,0,0|3,0,0]=4 88 B23R3.2804070 COC(=O)C(C)Nc1cccc2c1cc3c(c2)cccc3 7a_100000033484_100000211248 [0,1,0,0,0,0|3,0,0]=4 89 B23R3.2804070 COC(=O)C(C)Nc1cccc2c1nc3c(c2)cccc3 34a_200000072084_100000211248 [0,1,0,0,0,0|2,0,0]=3 90 B23R3.2804070 COC(=O)C(C)Oc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100000211248 [0,1,0,0,0,0|0,0,0]=1 91 B23R3.2804070 COC(=O)C(C)Sc1cccc2c1cc3c(c2)cccc3 62a_100000211248_100010188719 [0,1,0,0,0,0|2,1,0]=4 92 B23R3.15426651 COC(C)(C)CNc1cccc2c1nc3c(n2)cccc3 27a_100000763424_100010275551 [0,1,0,0,0,0|2,0,1]=4 93 B23R3.15426651 COC(C)(C)COc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100000701081 [0,1,0,0,0,0|1,0,1]=3 94 B23R3.18703026 CCC(CC)COc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100011215472 [0,1,0,0,0,0|2,0,1]=4 95 B23R3.18703026 CCC(CNc1cccc2c1nc3c(n2)cccc3)OC 27a_100000731041_100010275551 [0,1,0,0,0,0|2,0,1]=4 96 B23R3.18703026 COC(COc1cccc2c1nc3c(n2)cccc3)OC 34a_100000029702_100000211822 [0,1,0,0,0,0|0,0,2]=3 97 B23R3.21054348 CCC(=O)CC(=O)c1cccc2c1nc3c(c2)cccc3 1458a_100020631721_100000747405 [0,1,0,0,0,0|3,0,0]=4 98 B23R3.21054348 CCC(=O)CC(=O)c1cccc2c1nc3c(n2)cccc3 1458a_200016989829_100000747405 [0,1,0,0,0,0|2,0,0]=3 99 B23R3.21054348 CNC(=O)CC(=O)c1cccc2c1nc3c(c2)cccc3 1458a_100020631721_100000183359 [0,1,0,0,0,0|3,0,0]=4 100 B23R3.21054348 CNC(=O)CC(=O)c1cccc2c1nc3c(n2)cccc3 1458a_200016989829_100000183359 [0,1,0,0,0,0|2,0,0]=3 101 B23R3.21054348 CNC(=O)CN(C)c1cccc2c1nc3c(n2)cccc3 27a_100000189611_100010275551 [0,1,0,0,0,0|2,0,0]=3 102 B23R3.21054348 COC(=O)CC(=O)c1cccc2c1cc3c(c2)cccc3 1458a_200000010611_100000747449 [0,1,0,0,0,0|3,0,0]=4 103 B23R3.21054348 COC(=O)CC(=O)c1cccc2c1nc3c(c2)cccc3 1458a_100020631721_100000747449 [0,1,0,0,0,0|2,0,0]=3 104 B23R3.21054348 COC(=O)CC(=O)c1cccc2c1nc3c(n2)cccc3 1458a_200016989829_100000747449 [0,1,0,0,0,0|1,0,0]=2 105 B23R3.21054348 COC(=O)CN(C)c1cccc2c1nc3c(n2)cccc3 27a_100000198492_100010275551 [0,1,0,0,0,0|1,0,0]=2 106 B23R3.24938603 CNC(=O)CNc1cccc2c1nc3c(n2)ccc(c3)Cl 27a_100000693194_100160470744 [0,1,0,0,0,0|2,0,0]=3 107 B23R3.24938603 CO[C@H](C)CNc1cccc2c1nc3c(n2)ccc(c3)Cl 27a_100020591295_100160470744 [0,1,0,0,0,0|2,0,1]=4 108 B23R3.38477009 CC(=O)C(=O)CNc1cccc2c1nc3c(c2)cccc3 34a_200000072084_100011261029 [0,1,0,0,0,0|3,0,0]=4 109 B23R3.38477009 CC(=O)C(=O)COc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100011261029 [0,1,0,0,0,0|1,0,0]=2 110 B23R3.38477009 CC(C)C(=O)CNc1cccc2c1nc3c(c2)cccc3 34a_200000072084_100000753385 [0,1,0,0,0,0|3,0,0]=4 111 B23R3.38477009 CC(C)C(=O)COc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100000753385 [0,1,0,0,0,0|1,0,0]=2 112 B23R3.38477009 CN(C)C(=O)CCc1cccc2c1nc3c(n2)cccc3 271570a_200010232142_100010275551 [0,1,0,0,0,0|2,0,0]=3 113 B23R3.38477009 CN(C)C(=O)CNc1cccc2c1nc3c(c2)cccc3 34a_200000072084_100000692301 [0,1,0,0,0,0|3,0,0]=4 114 B23R3.38477009 CN(C)C(=O)CNc1cccc2c1nc3c(n2)cccc3 27a_100015183351_100010275551 [0,1,0,0,0,0|2,0,0]=3 115 B23R3.38477009 CN(C)C(=O)COc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100000692301 [0,1,0,0,0,0|1,0,0]=2 116 B23R3.187759772 CNC(=O)CNc1cccc2c1nc3c(n2)cccc3Cl 27a_100000693194_100160470748 [0,1,0,0,0,0|2,0,0]=3 117 B23R3.187759772 CO[C@H](C)CNc1cccc2c1nc3c(n2)cccc3Cl 27a_100020591295_100160470748 [0,1,0,0,0,0|2,0,1]=4 118 B21R2.22847 CNC(=O)COc1cccc(c1)Sc2ccccc2Br 62a_100000695589_200000150594 [0,0,1,0,0,0|3,0,0]=4 119 B21R2.22847 CNC(=O)COc1cccc(c1)Sc2ccccc2Br 62a_200000150594_100000695589 [0,0,1,0,0,0|3,0,0]=4 120 B21R2.22847 CNC(=O)COc1cccc(c1)Sc2ccccc2C 62a_100000210755_200000150594 [0,0,1,0,0,0|3,0,0]=4 121 B21R2.22847 CNC(=O)COc1cccc(c1)Sc2ccccc2C 62a_200000150594_100000210755 [0,0,1,0,0,0|3,0,0]=4 122 B21R2.22847 CNC(=O)COc1cccc(c1)Sc2ccccc2Cl 62a_100000764095_200000150594 [0,0,1,0,0,0|3,0,0]=4 123 B21R2.22847 CNC(=O)COc1cccc(c1)Sc2ccccc2Cl 62a_200000150594_100000764095 [0,0,1,0,0,0|3,0,0]=4 124 B21R2.22847 CNC(=O)COc1cccc(c1)Sc2ccccc2F 62a_100011215700_200000150594 [0,0,1,0,0,0|3,0,0]=4 125 B21R2.22847 CNC(=O)COc1cccc(c1)Sc2ccccc2F 62a_200000150594_100011215700 [0,0,1,0,0,0|3,0,0]=4 126 B21R2.22847 CNC(=O)COc1cccc(c1)Sc2ccccc2N 62a_100000210017_200000150594 [0,0,1,0,0,0|2,0,1]=4 127 B21R2.22847 CNC(=O)COc1cccc(c1)Sc2ccccc2N 62a_200000150594_100000210017 [0,0,1,0,0,0|2,0,1]=4 128 B21R2.22847 CNC(=O)COc1cccc(c1)Sc2ccccc2O 62a_100000739446_200000150594 [0,0,1,0,0,0|3,0,0]=4 129 B21R2.22847 CNC(=O)COc1cccc(c1)Sc2ccccc2O 62a_200000150594_100000739446 [0,0,1,0,0,0|3,0,0]=4 130 B21R2.22847 COC(=O)CCc1cccc(c1)Sc2ccccc2Br 62a_100000151591_100000695589 [0,0,1,0,0,0|3,0,0]=4 131 B21R2.22847 COC(=O)CCc1cccc(c1)Sc2ccccc2Br 62a_100000695589_100000151591 [0,0,1,0,0,0|3,0,0]=4 132 B21R2.22847 COC(=O)CCc1cccc(c1)Sc2ccccc2C 62a_100000151591_100000210755 [0,0,1,0,0,0|3,0,0]=4 133 B21R2.22847 COC(=O)CCc1cccc(c1)Sc2ccccc2C 62a_100000210755_100000151591 [0,0,1,0,0,0|3,0,0]=4 134 B21R2.22847 COC(=O)CCc1cccc(c1)Sc2ccccc2Cl 62a_100000151591_100000764095 [0,0,1,0,0,0|3,0,0]=4 135 B21R2.22847 COC(=O)CCc1cccc(c1)Sc2ccccc2Cl 62a_100000764095_100000151591 [0,0,1,0,0,0|3,0,0]=4 136 B21R2.22847 COC(=O)CCc1cccc(c1)Sc2ccccc2F 62a_100000151591_100011215700 [0,0,1,0,0,0|3,0,0]=4 137 B21R2.22847 COC(=O)CCc1cccc(c1)Sc2ccccc2F 62a_100011215700_100000151591 [0,0,1,0,0,0|3,0,0]=4 138 B21R2.22847 COC(=O)CCc1cccc(c1)Sc2ccccc2N 62a_100000151591_100000210017 [0,0,1,0,0,0|2,0,1]=4 139 B21R2.22847 COC(=O)CCc1cccc(c1)Sc2ccccc2N 62a_100000210017_100000151591 [0,0,1,0,0,0|2,0,1]=4 140 B21R2.22847 COC(=O)CCc1cccc(c1)Sc2ccccc2O 62a_100000151591_100000739446 [0,0,1,0,0,0|3,0,0]=4 141 B21R2.22847 COC(=O)CCc1cccc(c1)Sc2ccccc2O 62a_100000739446_100000151591 [0,0,1,0,0,0|3,0,0]=4 142 B21R2.22847 COC(=O)COc1cccc(c1)Sc2c[nH]ccc2=O 62a_100009998708_200000148702 [0,0,1,0,0,0|3,0,0]=4 143 B21R2.22847 COC(=O)COc1cccc(c1)Sc2c[nH]ccc2=O 62a_200000148702_100009998708 [0,0,1,0,0,0|3,0,0]=4 144 B21R2.22847 COC(=O)COc1cccc(c1)Sc2c[nH]ccc2=S 62a_200000148702_200012280681 [0,0,1,0,0,0|3,0,0]=4 145 B21R2.22847 COC(=O)COc1cccc(c1)Sc2c[nH]ccc2=S 62a_200012280681_200000148702 [0,0,1,0,0,0|3,0,0]=4 146 B21R2.22847 COC(=O)COc1cccc(c1)Sc2cccc[n+]2C 62a_200000148702_100000212160 [0,0,1,0,0,0|3,0,0]=4 147 B21R2.22847 COC(=O)COc1cccc(c1)Sc2cccc[n+]2[O-] 62a_200000148702_200000042595 [0,0,1,0,0,0|3,0,0]=4 148 B21R2.22847 COC(=O)COc1cccc(c1)Sc2ccccc2Br 62a_100000695589_200000148702 [0,0,1,0,0,0|2,0,0]=3 149 B21R2.22847 COC(=O)COc1cccc(c1)Sc2ccccc2Br 62a_200000148702_100000695589 [0,0,1,0,0,0|2,0,0]=3 150 B21R2.22847 COC(=O)COc1cccc(c1)Sc2ccccc2C 62a_100000210755_200000148702 [0,0,1,0,0,0|2,0,0]=3 151 B21R2.22847 COC(=O)COc1cccc(c1)Sc2ccccc2C 62a_200000148702_100000210755 [0,0,1,0,0,0|2,0,0]=3 152 B21R2.22847 COC(=O)COc1cccc(c1)Sc2ccccc2Cl 62a_100000764095_200000148702 [0,0,1,0,0,0|2,0,0]=3 153 B21R2.22847 COC(=O)COc1cccc(c1)Sc2ccccc2Cl 62a_200000148702_100000764095 [0,0,1,0,0,0|2,0,0]=3 154 B21R2.22847 COC(=O)COc1cccc(c1)Sc2ccccc2F 62a_100011215700_200000148702 [0,0,1,0,0,0|2,0,0]=3 155 B21R2.22847 COC(=O)COc1cccc(c1)Sc2ccccc2F 62a_200000148702_100011215700 [0,0,1,0,0,0|2,0,0]=3 156 B21R2.22847 COC(=O)COc1cccc(c1)Sc2ccccc2N 62a_100000210017_200000148702 [0,0,1,0,0,0|1,0,1]=3 157 B21R2.22847 COC(=O)COc1cccc(c1)Sc2ccccc2N 62a_200000148702_100000210017 [0,0,1,0,0,0|1,0,1]=3 158 B21R2.22847 COC(=O)COc1cccc(c1)Sc2ccccc2O 62a_100000739446_200000148702 [0,0,1,0,0,0|2,0,0]=3 159 B21R2.22847 COC(=O)COc1cccc(c1)Sc2ccccc2O 62a_200000148702_100000739446 [0,0,1,0,0,0|2,0,0]=3 160 B21R2.22847 COC(=O)COc1cccc(c1)Sc2cccnc2Br 62a_100010202626_200000148702 [0,0,1,0,0,0|3,0,0]=4 161 B21R2.22847 COC(=O)COc1cccc(c1)Sc2cccnc2Br 62a_200000148702_100010202626 [0,0,1,0,0,0|3,0,0]=4 162 B21R2.22847 COC(=O)COc1cccc(c1)Sc2cccnc2C 62a_100000751574_200000148702 [0,0,1,0,0,0|3,0,0]=4 163 B21R2.22847 COC(=O)COc1cccc(c1)Sc2cccnc2C 62a_200000148702_100000751574 [0,0,1,0,0,0|3,0,0]=4 164 B21R2.22847 COC(=O)COc1cccc(c1)Sc2cccnc2Cl 62a_100000036424_200000148702 [0,0,1,0,0,0|3,0,0]=4 165 B21R2.22847 COC(=O)COc1cccc(c1)Sc2cccnc2Cl 62a_200000148702_100000036424 [0,0,1,0,0,0|3,0,0]=4 166 B21R2.22847 COC(=O)COc1cccc(c1)Sc2cccnc2F 62a_100009816115_200000148702 [0,0,1,0,0,0|3,0,0]=4 167 B21R2.22847 COC(=O)COc1cccc(c1)Sc2cccnc2F 62a_200000148702_100009816115 [0,0,1,0,0,0|3,0,0]=4 168 B21R2.22847 COC(=O)COc1cccc(c1)Sc2cccnc2N 62a_100000045569_200000148702 [0,0,1,0,0,0|2,0,1]=4 169 B21R2.22847 COC(=O)COc1cccc(c1)Sc2cccnc2N 62a_200000148702_100000045569 [0,0,1,0,0,0|2,0,1]=4 170 B21R2.22847 COC(=O)COc1cccc(c1)Sc2cccnc2O 62a_100000760158_200000148702 [0,0,1,0,0,0|3,0,0]=4 171 B21R2.22847 COC(=O)COc1cccc(c1)Sc2cccnc2O 62a_200000148702_100000760158 [0,0,1,0,0,0|3,0,0]=4 172 B21R2.22847 COC(=O)COc1cccc(c1)Sc2ccncc2Br 62a_100000726257_200000148702 [0,0,1,0,0,0|3,0,0]=4 173 B21R2.22847 COC(=O)COc1cccc(c1)Sc2ccncc2Br 62a_200000148702_100000726257 [0,0,1,0,0,0|3,0,0]=4 174 B21R2.22847 COC(=O)COc1cccc(c1)Sc2ccncc2C 62a_100000765111_200000148702 [0,0,1,0,0,0|3,0,0]=4 175 B21R2.22847 COC(=O)COc1cccc(c1)Sc2ccncc2C 62a_200000148702_100000765111 [0,0,1,0,0,0|3,0,0]=4 176 B21R2.22847 COC(=O)COc1cccc(c1)Sc2ccncc2Cl 62a_100000708259_200000148702 [0,0,1,0,0,0|3,0,0]=4 177 B21R2.22847 COC(=O)COc1cccc(c1)Sc2ccncc2Cl 62a_200000148702_100000708259 [0,0,1,0,0,0|3,0,0]=4 178 B21R2.22847 COC(=O)COc1cccc(c1)Sc2ccncc2F 62a_100000047030_200000148702 [0,0,1,0,0,0|3,0,0]=4 179 B21R2.22847 COC(=O)COc1cccc(c1)Sc2ccncc2F 62a_200000148702_100000047030 [0,0,1,0,0,0|3,0,0]=4 180 B21R2.22847 COC(=O)COc1cccc(c1)Sc2ccncc2N 62a_100000756074_200000148702 [0,0,1,0,0,0|2,0,1]=4 181 B21R2.22847 COC(=O)COc1cccc(c1)Sc2ccncc2N 62a_200000148702_100000756074 [0,0,1,0,0,0|2,0,1]=4 182 B21R2.22847 COC(=O)COc1cccc(c1)Sc2ccncc2O 62a_100009817591_200000148702 [0,0,1,0,0,0|3,0,0]=4 183 B21R2.22847 COC(=O)COc1cccc(c1)Sc2ccncc2O 62a_200000148702_100009817591 [0,0,1,0,0,0|3,0,0]=4 184 B21R2.22847 COC(=O)COc1cccc(c1)Sc2cnccc2Br 62a_100010138639_200000148702 [0,0,1,0,0,0|3,0,0]=4 185 B21R2.22847 COC(=O)COc1cccc(c1)Sc2cnccc2Br 62a_200000148702_100010138639 [0,0,1,0,0,0|3,0,0]=4 186 B21R2.22847 COC(=O)COc1cccc(c1)Sc2cnccc2C 62a_100000761580_200000148702 [0,0,1,0,0,0|3,0,0]=4 187 B21R2.22847 COC(=O)COc1cccc(c1)Sc2cnccc2C 62a_200000148702_100000761580 [0,0,1,0,0,0|3,0,0]=4 188 B21R2.22847 COC(=O)COc1cccc(c1)Sc2cnccc2Cl 62a_100009995489_200000148702 [0,0,1,0,0,0|3,0,0]=4 189 B21R2.22847 COC(=O)COc1cccc(c1)Sc2cnccc2Cl 62a_200000148702_100009995489 [0,0,1,0,0,0|3,0,0]=4 190 B21R2.22847 COC(=O)COc1cccc(c1)Sc2cnccc2F 62a_100009820683_200000148702 [0,0,1,0,0,0|3,0,0]=4 191 B21R2.22847 COC(=O)COc1cccc(c1)Sc2cnccc2F 62a_200000148702_100009820683 [0,0,1,0,0,0|3,0,0]=4 192 B21R2.22847 COC(=O)COc1cccc(c1)Sc2cnccc2N 62a_100000047001_200000148702 [0,0,1,0,0,0|2,0,1]=4 193 B21R2.22847 COC(=O)COc1cccc(c1)Sc2cnccc2N 62a_200000148702_100000047001 [0,0,1,0,0,0|2,0,1]=4 194 B21R2.22847 COC(=O)COc1cccc(c1)Sc2ncccc2Br 62a_100000696092_200000148702 [0,0,1,0,0,0|3,0,0]=4 195 B21R2.22847 COC(=O)COc1cccc(c1)Sc2ncccc2Br 62a_200000148702_100000696092 [0,0,1,0,0,0|3,0,0]=4 196 B21R2.22847 COC(=O)COc1cccc(c1)Sc2ncccc2C 62a_100000751373_200000148702 [0,0,1,0,0,0|3,0,0]=4 197 B21R2.22847 COC(=O)COc1cccc(c1)Sc2ncccc2C 62a_200000148702_100000751373 [0,0,1,0,0,0|3,0,0]=4 198 B21R2.22847 COC(=O)COc1cccc(c1)Sc2ncccc2Cl 62a_100011356963_200000148702 [0,0,1,0,0,0|3,0,0]=4 199 B21R2.22847 COC(=O)COc1cccc(c1)Sc2ncccc2Cl 62a_200000148702_100011356963 [0,0,1,0,0,0|3,0,0]=4 200 B21R2.22847 COC(=O)COc1cccc(c1)Sc2ncccc2F 62a_100000685392_200000148702 [0,0,1,0,0,0|3,0,0]=4 201 B21R2.22847 COC(=O)COc1cccc(c1)Sc2ncccc2F 62a_200000148702_100000685392 [0,0,1,0,0,0|3,0,0]=4 202 B21R2.22847 COC(=O)COc1cccc(c1)Sc2ncccc2N 62a_100000688686_200000148702 [0,0,1,0,0,0|2,0,1]=4 203 B21R2.22847 COC(=O)COc1cccc(c1)Sc2ncccc2N 62a_200000148702_100000688686 [0,0,1,0,0,0|2,0,1]=4 204 B21R2.22847 COC(=O)COc1cccc(c1)Sc2ncccc2O 62a_100000034122_200000148702 [0,0,1,0,0,0|3,0,0]=4 205 B21R2.22847 COC(=O)COc1cccc(c1)Sc2ncccc2O 62a_200000148702_100000034122 [0,0,1,0,0,0|3,0,0]=4 206 B21R2.22847 COC(=O)CSc1cccc(c1)Sc2ccccc2Br 62a_100000695589_100011756034 [0,0,1,0,0,0|2,1,0]=4 207 B21R2.22847 COC(=O)CSc1cccc(c1)Sc2ccccc2Br 62a_100011756034_100000695589 [0,0,1,0,0,0|2,1,0]=4 208 B21R2.22847 COC(=O)CSc1cccc(c1)Sc2ccccc2C 62a_100000210755_100011756034 [0,0,1,0,0,0|2,1,0]=4 209 B21R2.22847 COC(=O)CSc1cccc(c1)Sc2ccccc2C 62a_100011756034_100000210755 [0,0,1,0,0,0|2,1,0]=4 210 B21R2.22847 COC(=O)CSc1cccc(c1)Sc2ccccc2Cl 62a_100000764095_100011756034 [0,0,1,0,0,0|2,1,0]=4 211 B21R2.22847 COC(=O)CSc1cccc(c1)Sc2ccccc2Cl 62a_100011756034_100000764095 [0,0,1,0,0,0|2,1,0]=4 212 B21R2.22847 COC(=O)CSc1cccc(c1)Sc2ccccc2F 62a_100011215700_100011756034 [0,0,1,0,0,0|2,1,0]=4 213 B21R2.22847 COC(=O)CSc1cccc(c1)Sc2ccccc2F 62a_100011756034_100011215700 [0,0,1,0,0,0|2,1,0]=4 214 B21R2.22847 COC(=O)CSc1cccc(c1)Sc2ccccc2N 62a_100000210017_100011756034 [0,0,1,0,0,0|1,1,1]=4 215 B21R2.22847 COC(=O)CSc1cccc(c1)Sc2ccccc2N 62a_100011756034_100000210017 [0,0,1,0,0,0|1,1,1]=4 216 B21R2.22847 COC(=O)CSc1cccc(c1)Sc2ccccc2O 62a_100000739446_100011756034 [0,0,1,0,0,0|2,1,0]=4 217 B21R2.22847 COC(=O)CSc1cccc(c1)Sc2ccccc2O 62a_100011756034_100000739446 [0,0,1,0,0,0|2,1,0]=4 218 B21R2.371061 CNC(=O)COc1ccccc1Sc2ccccc2Br 62a_100000695589_200000148481 [0,0,1,0,0,0|3,0,0]=4 219 B21R2.371061 CNC(=O)COc1ccccc1Sc2ccccc2Br 62a_200000148481_100000695589 [0,0,1,0,0,0|3,0,0]=4 220 B21R2.371061 CNC(=O)COc1ccccc1Sc2ccccc2C 62a_100000210755_200000148481 [0,0,1,0,0,0|3,0,0]=4 221 B21R2.371061 CNC(=O)COc1ccccc1Sc2ccccc2C 62a_200000148481_100000210755 [0,0,1,0,0,0|3,0,0]=4 222 B21R2.371061 CNC(=O)COc1ccccc1Sc2ccccc2Cl 62a_100000764095_200000148481 [0,0,1,0,0,0|3,0,0]=4 223 B21R2.371061 CNC(=O)COc1ccccc1Sc2ccccc2Cl 62a_200000148481_100000764095 [0,0,1,0,0,0|3,0,0]=4 224 B21R2.371061 CNC(=O)COc1ccccc1Sc2ccccc2F 62a_100011215700_200000148481 [0,0,1,0,0,0|3,0,0]=4 225 B21R2.371061 CNC(=O)COc1ccccc1Sc2ccccc2F 62a_200000148481_100011215700 [0,0,1,0,0,0|3,0,0]=4 226 B21R2.371061 CNC(=O)COc1ccccc1Sc2ccccc2N 62a_100000210017_200000148481 [0,0,1,0,0,0|2,0,1]=4 227 B21R2.371061 CNC(=O)COc1ccccc1Sc2ccccc2N 62a_200000148481_100000210017 [0,0,1,0,0,0|2,0,1]=4 228 B21R2.371061 CNC(=O)COc1ccccc1Sc2ccccc2O 62a_100000739446_200000148481 [0,0,1,0,0,0|3,0,0]=4 229 B21R2.371061 CNC(=O)COc1ccccc1Sc2ccccc2O 62a_200000148481_100000739446 [0,0,1,0,0,0|3,0,0]=4 230 B21R2.371061 COC(=O)CCc1ccccc1Sc2ccccc2Br 62a_100000695589_100009815308 [0,0,1,0,0,0|3,0,0]=4 231 B21R2.371061 COC(=O)CCc1ccccc1Sc2ccccc2Br 62a_100009815308_100000695589 [0,0,1,0,0,0|3,0,0]=4 232 B21R2.371061 COC(=O)CCc1ccccc1Sc2ccccc2C 62a_100000210755_100009815308 [0,0,1,0,0,0|3,0,0]=4 233 B21R2.371061 COC(=O)CCc1ccccc1Sc2ccccc2C 62a_100009815308_100000210755 [0,0,1,0,0,0|3,0,0]=4 234 B21R2.371061 COC(=O)CCc1ccccc1Sc2ccccc2Cl 62a_100000764095_100009815308 [0,0,1,0,0,0|3,0,0]=4 235 B21R2.371061 COC(=O)CCc1ccccc1Sc2ccccc2Cl 62a_100009815308_100000764095 [0,0,1,0,0,0|3,0,0]=4 236 B21R2.371061 COC(=O)CCc1ccccc1Sc2ccccc2F 62a_100009815308_100011215700 [0,0,1,0,0,0|3,0,0]=4 237 B21R2.371061 COC(=O)CCc1ccccc1Sc2ccccc2F 62a_100011215700_100009815308 [0,0,1,0,0,0|3,0,0]=4 238 B21R2.371061 COC(=O)CCc1ccccc1Sc2ccccc2N 62a_100000210017_100009815308 [0,0,1,0,0,0|2,0,1]=4 239 B21R2.371061 COC(=O)CCc1ccccc1Sc2ccccc2N 62a_100009815308_100000210017 [0,0,1,0,0,0|2,0,1]=4 240 B21R2.371061 COC(=O)CCc1ccccc1Sc2ccccc2O 62a_100000739446_100009815308 [0,0,1,0,0,0|3,0,0]=4 241 B21R2.371061 COC(=O)CCc1ccccc1Sc2ccccc2O 62a_100009815308_100000739446 [0,0,1,0,0,0|3,0,0]=4 242 B21R2.371061 COC(=O)CNc1ccccc1Oc2ccccc2C 2230a_100000188859_100000747449 [0,0,1,0,0,0|3,0,0]=4 243 B21R2.371061 COC(=O)CNc1ccccc1Oc2ccccc2C 34a_100000188859_100000747449 [0,0,1,0,0,0|3,0,0]=4 244 B21R2.371061 COC(=O)CNc1ccccc1Oc2ccccc2C 7a_100000188859_100000747449 [0,0,1,0,0,0|3,0,0]=4 245 B21R2.371061 COC(=O)COc1ccccc1Sc2c[nH]ccc2=O 62a_100009998708_200000173920 [0,0,1,0,0,0|3,0,0]=4 246 B21R2.371061 COC(=O)COc1ccccc1Sc2c[nH]ccc2=O 62a_200000173920_100009998708 [0,0,1,0,0,0|3,0,0]=4 247 B21R2.371061 COC(=O)COc1ccccc1Sc2c[nH]ccc2=S 62a_200000173920_200012280681 [0,0,1,0,0,0|3,0,0]=4 248 B21R2.371061 COC(=O)COc1ccccc1Sc2c[nH]ccc2=S 62a_200012280681_200000173920 [0,0,1,0,0,0|3,0,0]=4 249 B21R2.371061 COC(=O)COc1ccccc1Sc2cccc[n+]2C 62a_200000173920_100000212160 [0,0,1,0,0,0|3,0,0]=4 250 B21R2.371061 COC(=O)COc1ccccc1Sc2cccc[n+]2[O-] 62a_200000173920_200000042595 [0,0,1,0,0,0|3,0,0]=4 251 B21R2.371061 COC(=O)COc1ccccc1Sc2ccccc2Br 62a_100000695589_200000173920 [0,0,1,0,0,0|2,0,0]=3 252 B21R2.371061 COC(=O)COc1ccccc1Sc2ccccc2Br 62a_200000173920_100000695589 [0,0,1,0,0,0|2,0,0]=3 253 B21R2.371061 COC(=O)COc1ccccc1Sc2ccccc2C 62a_100000210755_200000173920 [0,0,1,0,0,0|2,0,0]=3 254 B21R2.371061 COC(=O)COc1ccccc1Sc2ccccc2C 62a_200000173920_100000210755 [0,0,1,0,0,0|2,0,0]=3 255 B21R2.371061 COC(=O)COc1ccccc1Sc2ccccc2Cl 62a_100000764095_200000173920 [0,0,1,0,0,0|2,0,0]=3 256 B21R2.371061 COC(=O)COc1ccccc1Sc2ccccc2Cl 62a_200000173920_100000764095 [0,0,1,0,0,0|2,0,0]=3 257 B21R2.371061 COC(=O)COc1ccccc1Sc2ccccc2F 62a_100011215700_200000173920 [0,0,1,0,0,0|2,0,0]=3 258 B21R2.371061 COC(=O)COc1ccccc1Sc2ccccc2F 62a_200000173920_100011215700 [0,0,1,0,0,0|2,0,0]=3 259 B21R2.371061 COC(=O)COc1ccccc1Sc2ccccc2N 62a_100000210017_200000173920 [0,0,1,0,0,0|1,0,1]=3 260 B21R2.371061 COC(=O)COc1ccccc1Sc2ccccc2N 62a_200000173920_100000210017 [0,0,1,0,0,0|1,0,1]=3 261 B21R2.371061 COC(=O)COc1ccccc1Sc2ccccc2O 62a_100000739446_200000173920 [0,0,1,0,0,0|2,0,0]=3 262 B21R2.371061 COC(=O)COc1ccccc1Sc2ccccc2O 62a_200000173920_100000739446 [0,0,1,0,0,0|2,0,0]=3 263 B21R2.371061 COC(=O)COc1ccccc1Sc2cccnc2Br 62a_100010202626_200000173920 [0,0,1,0,0,0|3,0,0]=4 264 B21R2.371061 COC(=O)COc1ccccc1Sc2cccnc2Br 62a_200000173920_100010202626 [0,0,1,0,0,0|3,0,0]=4 265 B21R2.371061 COC(=O)COc1ccccc1Sc2cccnc2C 62a_100000751574_200000173920 [0,0,1,0,0,0|3,0,0]=4 266 B21R2.371061 COC(=O)COc1ccccc1Sc2cccnc2C 62a_200000173920_100000751574 [0,0,1,0,0,0|3,0,0]=4 267 B21R2.371061 COC(=O)COc1ccccc1Sc2cccnc2Cl 62a_100000036424_200000173920 [0,0,1,0,0,0|3,0,0]=4 268 B21R2.371061 COC(=O)COc1ccccc1Sc2cccnc2Cl 62a_200000173920_100000036424 [0,0,1,0,0,0|3,0,0]=4 269 B21R2.371061 COC(=O)COc1ccccc1Sc2cccnc2F 62a_100009816115_200000173920 [0,0,1,0,0,0|3,0,0]=4 270 B21R2.371061 COC(=O)COc1ccccc1Sc2cccnc2F 62a_200000173920_100009816115 [0,0,1,0,0,0|3,0,0]=4 271 B21R2.371061 COC(=O)COc1ccccc1Sc2cccnc2N 62a_100000045569_200000173920 [0,0,1,0,0,0|2,0,1]=4 272 B21R2.371061 COC(=O)COc1ccccc1Sc2cccnc2N 62a_200000173920_100000045569 [0,0,1,0,0,0|2,0,1]=4 273 B21R2.371061 COC(=O)COc1ccccc1Sc2cccnc2O 62a_100000760158_200000173920 [0,0,1,0,0,0|3,0,0]=4 274 B21R2.371061 COC(=O)COc1ccccc1Sc2cccnc2O 62a_200000173920_100000760158 [0,0,1,0,0,0|3,0,0]=4 275 B21R2.371061 COC(=O)COc1ccccc1Sc2ccncc2Br 62a_100000726257_200000173920 [0,0,1,0,0,0|3,0,0]=4 276 B21R2.371061 COC(=O)COc1ccccc1Sc2ccncc2Br 62a_200000173920_100000726257 [0,0,1,0,0,0|3,0,0]=4 277 B21R2.371061 COC(=O)COc1ccccc1Sc2ccncc2C 62a_100000765111_200000173920 [0,0,1,0,0,0|3,0,0]=4 278 B21R2.371061 COC(=O)COc1ccccc1Sc2ccncc2C 62a_200000173920_100000765111 [0,0,1,0,0,0|3,0,0]=4 279 B21R2.371061 COC(=O)COc1ccccc1Sc2ccncc2Cl 62a_100000708259_200000173920 [0,0,1,0,0,0|3,0,0]=4 280 B21R2.371061 COC(=O)COc1ccccc1Sc2ccncc2Cl 62a_200000173920_100000708259 [0,0,1,0,0,0|3,0,0]=4 281 B21R2.371061 COC(=O)COc1ccccc1Sc2ccncc2F 62a_100000047030_200000173920 [0,0,1,0,0,0|3,0,0]=4 282 B21R2.371061 COC(=O)COc1ccccc1Sc2ccncc2F 62a_200000173920_100000047030 [0,0,1,0,0,0|3,0,0]=4 283 B21R2.371061 COC(=O)COc1ccccc1Sc2ccncc2N 62a_100000756074_200000173920 [0,0,1,0,0,0|2,0,1]=4 284 B21R2.371061 COC(=O)COc1ccccc1Sc2ccncc2N 62a_200000173920_100000756074 [0,0,1,0,0,0|2,0,1]=4 285 B21R2.371061 COC(=O)COc1ccccc1Sc2ccncc2O 62a_100009817591_200000173920 [0,0,1,0,0,0|3,0,0]=4 286 B21R2.371061 COC(=O)COc1ccccc1Sc2ccncc2O 62a_200000173920_100009817591 [0,0,1,0,0,0|3,0,0]=4 287 B21R2.371061 COC(=O)COc1ccccc1Sc2cnccc2Br 62a_100010138639_200000173920 [0,0,1,0,0,0|3,0,0]=4 288 B21R2.371061 COC(=O)COc1ccccc1Sc2cnccc2Br 62a_200000173920_100010138639 [0,0,1,0,0,0|3,0,0]=4 289 B21R2.371061 COC(=O)COc1ccccc1Sc2cnccc2C 62a_100000761580_200000173920 [0,0,1,0,0,0|3,0,0]=4 290 B21R2.371061 COC(=O)COc1ccccc1Sc2cnccc2C 62a_200000173920_100000761580 [0,0,1,0,0,0|3,0,0]=4 291 B21R2.371061 COC(=O)COc1ccccc1Sc2cnccc2Cl 62a_100009995489_200000173920 [0,0,1,0,0,0|3,0,0]=4 292 B21R2.371061 COC(=O)COc1ccccc1Sc2cnccc2Cl 62a_200000173920_100009995489 [0,0,1,0,0,0|3,0,0]=4 293 B21R2.371061 COC(=O)COc1ccccc1Sc2cnccc2F 62a_100009820683_200000173920 [0,0,1,0,0,0|3,0,0]=4 294 B21R2.371061 COC(=O)COc1ccccc1Sc2cnccc2F 62a_200000173920_100009820683 [0,0,1,0,0,0|3,0,0]=4 295 B21R2.371061 COC(=O)COc1ccccc1Sc2cnccc2N 62a_100000047001_200000173920 [0,0,1,0,0,0|2,0,1]=4 296 B21R2.371061 COC(=O)COc1ccccc1Sc2cnccc2N 62a_200000173920_100000047001 [0,0,1,0,0,0|2,0,1]=4 297 B21R2.371061 COC(=O)COc1ccccc1Sc2ncccc2Br 62a_100000696092_200000173920 [0,0,1,0,0,0|3,0,0]=4 298 B21R2.371061 COC(=O)COc1ccccc1Sc2ncccc2Br 62a_200000173920_100000696092 [0,0,1,0,0,0|3,0,0]=4 299 B21R2.371061 COC(=O)COc1ccccc1Sc2ncccc2C 62a_100000751373_200000173920 [0,0,1,0,0,0|3,0,0]=4 300 B21R2.371061 COC(=O)COc1ccccc1Sc2ncccc2C 62a_200000173920_100000751373 [0,0,1,0,0,0|3,0,0]=4 301 B21R2.371061 COC(=O)COc1ccccc1Sc2ncccc2Cl 62a_100011356963_200000173920 [0,0,1,0,0,0|3,0,0]=4 302 B21R2.371061 COC(=O)COc1ccccc1Sc2ncccc2Cl 62a_200000173920_100011356963 [0,0,1,0,0,0|3,0,0]=4 303 B21R2.371061 COC(=O)COc1ccccc1Sc2ncccc2F 62a_100000685392_200000173920 [0,0,1,0,0,0|3,0,0]=4 304 B21R2.371061 COC(=O)COc1ccccc1Sc2ncccc2F 62a_200000173920_100000685392 [0,0,1,0,0,0|3,0,0]=4 305 B21R2.371061 COC(=O)COc1ccccc1Sc2ncccc2N 62a_100000688686_200000173920 [0,0,1,0,0,0|2,0,1]=4 306 B21R2.371061 COC(=O)COc1ccccc1Sc2ncccc2N 62a_200000173920_100000688686 [0,0,1,0,0,0|2,0,1]=4 307 B21R2.371061 COC(=O)COc1ccccc1Sc2ncccc2O 62a_100000034122_200000173920 [0,0,1,0,0,0|3,0,0]=4 308 B21R2.371061 COC(=O)COc1ccccc1Sc2ncccc2O 62a_200000173920_100000034122 [0,0,1,0,0,0|3,0,0]=4 309 B23R4.2710273 O=C1CCC1Nc2cccc3c2nc4c(c3)cccc4 34a_200000072084_100009892977 [0,0,0,1,0,0|3,0,0]=4 310 B23R4.2710273 O=C1CCC1Oc2cccc3c2nc4c(n3)cccc4 34a_100000029702_100009892977 [0,0,0,1,0,0|1,0,0]=2 311 B23R4.8645649 O=C1C=C(CC1)c2cccc3c2nc4c(n3)cccc4 271570a_100010737933_100010275551 [0,0,0,1,0,0|2,0,1]=4 312 B23R4.8645649 O=C1CN(CN1)c2cccc3c2nc4c(n3)cccc4 27a_200000708111_100010275551 [0,0,0,1,0,0|2,0,0]=3 313 B23R4.36746409 COC1CN(C1)c2cccc3c2nc4c(n3)cccc4 27a_100000755009_100010275551 [0,0,0,1,0,0|2,0,1]=4 314 B23R4.89847777 CC1(CO1)COc2cccc3c2nc4c(n3)cccc4 34a_100000029702_100000760498 [0,0,0,1,0,0|1,0,1]=3 315 B23R4.831479345 c1ccc2nc3c(cccc3nc2c1)NC[C@@H]4CCO4 27a_100020831831_100010275551 [0,0,0,1,0,0|2,0,1]=4 316 B23R4.831479345 c1ccc2nc3c(cccc3nc2c1)OCC4CCC4 34a_100000029702_100000763275 [0,0,0,1,0,0|2,0,1]=4 317 B23R4.831479345 c1ccc2nc3c(cccc3nc2c1)OCC4CCO4 34a_100000029702_100000103362 [0,0,0,1,0,0|1,0,1]=3 318 B21R3.667737 CCC(=O)COc1cccc2c1oc3c2cccc3 7a_100010256078_100000747405 [0,0,0,0,1,0|2,0,0]=3 319 B21R3.667737 CNC(=O)CNc1cccc2c1oc3c2cccc3 34a_200000102501_100000183359 [0,0,0,0,1,0|3,0,0]=4 320 B21R3.667737 CNC(=O)COc1cccc2c1oc3c2cccc3 34a_100010256078_100000183359 [0,0,0,0,1,0|2,0,0]=3 321 B21R3.667737 CNC(=O)COc1cccc2c1oc3c2cccc3 7a_100010256078_100000183359 [0,0,0,0,1,0|2,0,0]=3 322 B21R3.667737 COC(=O)CNc1cccc2c1oc3c2cccc3 34a_200000102501_100000747449 [0,0,0,0,1,0|2,0,0]=3 323 B21R3.667737 COC(=O)COc1cccc2c1oc3c2cccc3 34a_100010256078_100000747449 [0,0,0,0,1,0|1,0,0]=2 324 B21R3.667737 COC(=O)COc1cccc2c1oc3c2cccc3 7a_100010256078_100000747449 [0,0,0,0,1,0|1,0,0]=2 325 B21R3.667737 COC(=O)CSc1nccc2c1[nH]c3c2cccc3 62a_100000747449_100010159298 [0,0,0,0,1,0|1,1,1]=4 326 B21R3.9527625 C=CC(=O)Nc1cccc2c1nc3c(n2)cccc3 1626a_100000029703_100000185746 [0,0,0,0,1,0|2,0,1]=4 327 B21R3.9527625 CCC(=O)Nc1cccc2c1nc3c(c2)cccc3 11a_200000072084_100000210414 [0,0,0,0,1,0|3,0,0]=4 328 B21R3.9527625 CCC(=O)Nc1cccc2c1nc3c(c2)cccc3 1626a_200000072084_100000210414 [0,0,0,0,1,0|3,0,0]=4 329 B21R3.9527625 CCC(=O)Nc1cccc2c1nc3c(c2)cccc3 22a_200000072084_100000210414 [0,0,0,0,1,0|3,0,0]=4 330 B21R3.9527625 CCC(=O)Nc1cccc2c1nc3c(c2)cccc3 527a_200000072084_100000210414 [0,0,0,0,1,0|3,0,0]=4 331 B21R3.9527625 CCC(=O)Nc1cccc2c1nc3c(n2)cccc3 11a_100000029703_100000210414 [0,0,0,0,1,0|2,0,0]=3 332 B21R3.9527625 CCC(=O)Nc1cccc2c1nc3c(n2)cccc3 1626a_100000029703_100000210414 [0,0,0,0,1,0|2,0,0]=3 333 B21R3.9527625 CCC(C)Oc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100011215416 [0,0,0,0,1,0|2,0,1]=4 334 B21R3.9558879 CCC(=O)COc1cccc2c1c3c(o2)cccc3 7a_100010256132_100000747405 [0,0,0,0,1,0|2,0,0]=3 335 B21R3.9558879 CNC(=O)CNc1cccc2c1c3c(o2)cccc3 34a_100009830322_100000183359 [0,0,0,0,1,0|3,0,0]=4 336 B21R3.9558879 CNC(=O)COc1cccc2c1c3c(o2)cccc3 34a_100010256132_100000183359 [0,0,0,0,1,0|2,0,0]=3 337 B21R3.9558879 CNC(=O)COc1cccc2c1c3c(o2)cccc3 7a_100010256132_100000183359 [0,0,0,0,1,0|2,0,0]=3 338 B21R3.9558879 COC(=O)CNc1cccc2c1c3c(o2)cccc3 34a_100009830322_100000747449 [0,0,0,0,1,0|2,0,0]=3 339 B21R3.9558879 COC(=O)COc1cccc2c1c3c(o2)cccc3 34a_100010256132_100000747449 [0,0,0,0,1,0|1,0,0]=2 340 B21R3.9558879 COC(=O)COc1cccc2c1c3c(o2)cccc3 7a_100010256132_100000747449 [0,0,0,0,1,0|1,0,0]=2 341 B21R3.9558879 COC(=O)CSc1cccc2c1c3c([nH]2)ccnc3 62a_100000747449_200037665351 [0,0,0,0,1,0|1,1,1]=4 342 B23R3.26295344 CNC(=O)CCNc1cccc2c1nc3c(c2)cccc3 34a_200000072084_100012179268 [0,0,0,0,0,1|3,0,0]=4 343 B23R3.26295344 CNC(=O)CCNc1cccc2c1nc3c(n2)cccc3 27a_100000738227_100010275551 [0,0,0,0,0,1|2,0,0]=3 344 B23R3.26295344 CNC(=O)CCOc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100012179268 [0,0,0,0,0,1|1,0,0]=2 345 B23R3.26295344 COC(=O)CCNc1cccc2c1cc3c(c2)cccc3 34a_100000033484_100000742370 [0,0,0,0,0,1|3,0,0]=4 346 B23R3.26295344 COC(=O)CCNc1cccc2c1cc3c(c2)cccc3 7a_100000033484_100000204255 [0,0,0,0,0,1|3,0,0]=4 347 B23R3.26295344 COC(=O)CCNc1cccc2c1nc3c(c2)cccc3 34a_200000072084_100000742370 [0,0,0,0,0,1|2,0,0]=3 348 B23R3.26295344 COC(=O)CCOc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100000742370 [0,0,0,0,0,1|0,0,0]=1 349 B23R3.26295344 COC(=O)CCSc1cccc2c1cc3c(c2)cccc3 62a_100000204255_100010188719 [0,0,0,0,0,1|2,1,0]=4 350 B20R2.350 CCC(=O)COc1cccc(c1)Cc2ccccc2 7a_100000073777_100000747405 [1,0,1,0,0,0|2,0,0]=4 351 B20R2.350 CCC(=O)COc1cccc(c1)Nc2ccccc2 7a_100000031534_100000747405 [1,0,1,0,0,0|1,0,1]=4 352 B20R2.350 CCC(=O)COc1cccc(c1)Oc2ccccc2 7a_100000199087_100000747405 [1,0,1,0,0,0|2,0,0]=4 353 B20R2.350 CNC(=O)COc1cccc(c1)Cc2ccccc2 34a_100000073777_100000183359 [1,0,1,0,0,0|2,0,0]=4 354 B20R2.350 CNC(=O)COc1cccc(c1)Cc2ccccc2 7a_100000073777_100000183359 [1,0,1,0,0,0|2,0,0]=4 355 B20R2.350 CNC(=O)COc1cccc(c1)Nc2ccccc2 34a_100000031534_100000183359 [1,0,1,0,0,0|1,0,1]=4 356 B20R2.350 CNC(=O)COc1cccc(c1)Nc2ccccc2 7a_100000031534_100000183359 [1,0,1,0,0,0|1,0,1]=4 357 B20R2.350 CNC(=O)COc1cccc(c1)Oc2ccccc2 7a_100000199087_100000183359 [1,0,1,0,0,0|2,0,0]=4 358 B20R2.350 CNC(=O)COc1cccc(c1)Sc2ccccc2 62a_100000719477_200000150594 [1,0,1,0,0,0|2,0,0]=4 359 B20R2.350 CNC(=O)COc1cccc(c1)Sc2ccccc2 62a_200000150594_100000041952 [1,0,1,0,0,0|2,0,0]=4 360 B20R2.350 COC(=O)CCc1cccc(c1)Sc2ccccc2 62a_100000151591_100000041952 [1,0,1,0,0,0|2,0,0]=4 361 B20R2.350 COC(=O)CCc1cccc(c1)Sc2ccccc2 62a_100000719477_100000151591 [1,0,1,0,0,0|2,0,0]=4 362 B20R2.350 COC(=O)CNc1cccc(c1)Cc2ccccc2 2230a_200000043086_100000747449 [1,0,1,0,0,0|2,0,0]=4 363 B20R2.350 COC(=O)CNc1cccc(c1)Cc2ccccc2 34a_200000043086_100000747449 [1,0,1,0,0,0|2,0,0]=4 364 B20R2.350 COC(=O)CNc1cccc(c1)Cc2ccccc2 7a_200000043086_100000747449 [1,0,1,0,0,0|2,0,0]=4 365 B20R2.350 COC(=O)CNc1cccc(c1)Oc2ccccc2 2230a_100000210861_100000747449 [1,0,1,0,0,0|2,0,0]=4 366 B20R2.350 COC(=O)CNc1cccc(c1)Oc2ccccc2 34a_100000210861_100000747449 [1,0,1,0,0,0|2,0,0]=4 367 B20R2.350 COC(=O)CNc1cccc(c1)Oc2ccccc2 7a_100000210861_100000747449 [1,0,1,0,0,0|2,0,0]=4 368 B20R2.350 COC(=O)COc1cccc(c1)Cc2ccccc2 34a_100000073777_100000747449 [1,0,1,0,0,0|1,0,0]=3 369 B20R2.350 COC(=O)COc1cccc(c1)Cc2ccccc2 7a_100000073777_100000747449 [1,0,1,0,0,0|1,0,0]=3 370 B20R2.350 COC(=O)COc1cccc(c1)Nc2ccccc2 34a_100000031534_100000747449 [1,0,1,0,0,0|0,0,1]=3 371 B20R2.350 COC(=O)COc1cccc(c1)Nc2ccccc2 7a_100000031534_100000747449 [1,0,1,0,0,0|0,0,1]=3 372 B20R2.350 COC(=O)COc1cccc(c1)Oc2ccccc2 7a_100000199087_100000747449 [1,0,1,0,0,0|1,0,0]=3 373 B20R2.350 COC(=O)COc1cccc(c1)Sc2ccccc2 62a_100000719477_200000148702 [1,0,1,0,0,0|1,0,0]=3 374 B20R2.350 COC(=O)COc1cccc(c1)Sc2ccccc2 62a_200000148702_100000041952 [1,0,1,0,0,0|1,0,0]=3 375 B20R2.350 COC(=O)COc1cccc(c1)Sc2ccccn2 62a_100011216584_200000148702 [1,0,1,0,0,0|2,0,0]=4 376 B20R2.350 COC(=O)COc1cccc(c1)Sc2ccccn2 62a_200000148702_100011216584 [1,0,1,0,0,0|2,0,0]=4 377 B20R2.350 COC(=O)COc1cccc(c1)Sc2cccnc2 62a_100000210063_200000148702 [1,0,1,0,0,0|2,0,0]=4 378 B20R2.350 COC(=O)COc1cccc(c1)Sc2cccnc2 62a_200000148702_100000210063 [1,0,1,0,0,0|2,0,0]=4 379 B20R2.350 COC(=O)COc1cccc(c1)Sc2ccncc2 62a_100000728582_200000148702 [1,0,1,0,0,0|2,0,0]=4 380 B20R2.350 COC(=O)COc1cccc(c1)Sc2ccncc2 62a_200000148702_100000728582 [1,0,1,0,0,0|2,0,0]=4 381 B20R2.350 COC(=O)CSc1cccc(c1)Nc2ccccc2 62a_100000747449_100000701362 [1,0,1,0,0,0|0,1,1]=4 382 B20R2.350 COC(=O)CSc1cccc(c1)Oc2ccccc2 62a_100000747449_100009814285 [1,0,1,0,0,0|1,1,0]=4 383 B20R2.350 COC(=O)CSc1cccc(c1)Sc2ccccc2 62a_100000719477_100011756034 [1,0,1,0,0,0|1,1,0]=4 384 B20R2.350 COC(=O)CSc1cccc(c1)Sc2ccccc2 62a_100011756034_100000041952 [1,0,1,0,0,0|1,1,0]=4 385 B20R2.16153 CCC(=O)COc1ccccc1Cc2ccccc2 7a_100000211249_100000747405 [1,0,1,0,0,0|2,0,0]=4 386 B20R2.16153 CCC(=O)COc1ccccc1Oc2ccccc2 7a_100000074787_100000747405 [1,0,1,0,0,0|2,0,0]=4 387 B20R2.16153 CNC(=O)COc1ccccc1Cc2ccccc2 34a_100000211249_100000183359 [1,0,1,0,0,0|2,0,0]=4 388 B20R2.16153 CNC(=O)COc1ccccc1Cc2ccccc2 7a_100000211249_100000183359 [1,0,1,0,0,0|2,0,0]=4 389 B20R2.16153 CNC(=O)COc1ccccc1Oc2ccccc2 34a_100000074787_100000183359 [1,0,1,0,0,0|2,0,0]=4 390 B20R2.16153 CNC(=O)COc1ccccc1Oc2ccccc2 7a_100000074787_100000183359 [1,0,1,0,0,0|2,0,0]=4 391 B20R2.16153 CNC(=O)COc1ccccc1Sc2ccccc2 62a_100000719477_200000148481 [1,0,1,0,0,0|2,0,0]=4 392 B20R2.16153 CNC(=O)COc1ccccc1Sc2ccccc2 62a_200000148481_100000041952 [1,0,1,0,0,0|2,0,0]=4 393 B20R2.16153 COC(=O)CCc1ccccc1Sc2ccccc2 62a_100000719477_100009815308 [1,0,1,0,0,0|2,0,0]=4 394 B20R2.16153 COC(=O)CCc1ccccc1Sc2ccccc2 62a_100009815308_100000041952 [1,0,1,0,0,0|2,0,0]=4 395 B20R2.16153 COC(=O)CNc1ccccc1Cc2ccccc2 2230a_100000211252_100000747449 [1,0,1,0,0,0|2,0,0]=4 396 B20R2.16153 COC(=O)CNc1ccccc1Cc2ccccc2 34a_100000211252_100000747449 [1,0,1,0,0,0|2,0,0]=4 397 B20R2.16153 COC(=O)CNc1ccccc1Cc2ccccc2 7a_100000211252_100000747449 [1,0,1,0,0,0|2,0,0]=4 398 B20R2.16153 COC(=O)CNc1ccccc1Oc2ccccc2 2230a_100000182328_100000747449 [1,0,1,0,0,0|2,0,0]=4 399 B20R2.16153 COC(=O)CNc1ccccc1Oc2ccccc2 34a_100000182328_100000747449 [1,0,1,0,0,0|2,0,0]=4 400 B20R2.16153 COC(=O)CNc1ccccc1Sc2ccccc2 2230a_100000210917_100000747449 [1,0,1,0,0,0|2,0,0]=4 401 B20R2.16153 COC(=O)COc1ccccc1Cc2ccccc2 34a_100000211249_100000747449 [1,0,1,0,0,0|1,0,0]=3 402 B20R2.16153 COC(=O)COc1ccccc1Cc2ccccc2 7a_100000211249_100000747449 [1,0,1,0,0,0|1,0,0]=3 403 B20R2.16153 COC(=O)COc1ccccc1Oc2ccccc2 34a_100000074787_100000747449 [1,0,1,0,0,0|1,0,0]=3 404 B20R2.16153 COC(=O)COc1ccccc1Oc2ccccc2 7a_100000074787_100000747449 [1,0,1,0,0,0|1,0,0]=3 405 B20R2.16153 COC(=O)COc1ccccc1Oc2ccccn2 34a_100000748224_100000747449 [1,0,1,0,0,0|2,0,0]=4 406 B20R2.16153 COC(=O)COc1ccccc1Sc2ccccc2 62a_100000719477_200000173920 [1,0,1,0,0,0|1,0,0]=3 407 B20R2.16153 COC(=O)COc1ccccc1Sc2ccccc2 62a_200000173920_100000041952 [1,0,1,0,0,0|1,0,0]=3 408 B20R2.16153 COC(=O)COc1ccccc1Sc2ccccn2 62a_100011216584_200000173920 [1,0,1,0,0,0|2,0,0]=4 409 B20R2.16153 COC(=O)COc1ccccc1Sc2ccccn2 62a_200000173920_100011216584 [1,0,1,0,0,0|2,0,0]=4 410 B20R2.16153 COC(=O)COc1ccccc1Sc2cccnc2 62a_100000210063_200000173920 [1,0,1,0,0,0|2,0,0]=4 411 B20R2.16153 COC(=O)COc1ccccc1Sc2cccnc2 62a_200000173920_100000210063 [1,0,1,0,0,0|2,0,0]=4 412 B20R2.16153 COC(=O)COc1ccccc1Sc2ccncc2 62a_100000728582_200000173920 [1,0,1,0,0,0|2,0,0]=4 413 B20R2.16153 COC(=O)COc1ccccc1Sc2ccncc2 62a_200000173920_100000728582 [1,0,1,0,0,0|2,0,0]=4 414 B20R2.16153 COC(=O)CSc1ccccc1Cc2ccccc2 62a_100000747449_200011216382 [1,0,1,0,0,0|1,1,0]=4 415 B20R2.16153 COC(=O)CSc1ccccc1Cc2ccccc2 62a_200011216382_100000747449 [1,0,1,0,0,0|1,1,0]=4 416 B20R2.16153 COC(=O)CSc1ccccc1Nc2ccccc2 62a_100000747449_100009815782 [1,0,1,0,0,0|0,1,1]=4 417 B20R2.16153 COC(=O)CSc1ccccc1Oc2ccccc2 62a_100000747449_100000049502 [1,0,1,0,0,0|1,1,0]=4 418 B20R3.384724 C#CCOc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100000184674 [2,0,0,0,0,0|0,0,2]=4 419 B20R3.384724 C=CCNc1cccc2c1nc3c(n2)cccc3 27a_100020586998_100010275551 [2,0,0,0,0,0|1,0,1]=4 420 B20R3.384724 C=CCOc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100015514636 [2,0,0,0,0,0|0,0,1]=3 421 B20R3.384724 CCCCc1cccc2c1nc3c(n2)cccc3 271570a_100020621405_100010275551 [2,0,0,0,0,0|1,0,1]=4 422 B20R3.384724 CCCOc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100000210303 [2,0,0,0,0,0|0,0,1]=3 423 B20R3.384724 CSCOc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100011218213 [2,0,0,0,0,0|0,1,0]=3 424 B20R3.384724 FCCOc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100011217306 [2,0,0,0,0,0|1,0,1]=4 425 B20R3.384724 O=CCNc1cccc2c1nc3c(c2)cccc3 34a_200000072084_200009817547 [2,0,0,0,0,0|2,0,0]=4 426 B20R3.384724 O=CCOc1cccc2c1nc3c(n2)cccc3 34a_100000029702_200009817547 [2,0,0,0,0,0|0,0,0]=2 427 B20R3.384724 OCCNc1cccc2c1nc3c(n2)cccc3 27a_100000210304_100010275551 [2,0,0,0,0,0|1,0,1]=4 428 B20R3.384724 OCCOc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100000211926 [2,0,0,0,0,0|0,0,1]=3 429 B22R2.27170 COC(=O)COc1cc(cc(c1)Sc2ccccc2Br)C 62a_100000695589_100153394732 [0,1,1,0,0,0|2,0,0]=4 430 B22R2.27170 COC(=O)COc1cc(cc(c1)Sc2ccccc2Br)C 62a_100153394732_100000695589 [0,1,1,0,0,0|2,0,0]=4 431 B22R2.27170 COC(=O)COc1cc(cc(c1)Sc2ccccc2C)C 62a_100000210755_100153394732 [0,1,1,0,0,0|2,0,0]=4 432 B22R2.27170 COC(=O)COc1cc(cc(c1)Sc2ccccc2C)C 62a_100153394732_100000210755 [0,1,1,0,0,0|2,0,0]=4 433 B22R2.27170 COC(=O)COc1cc(cc(c1)Sc2ccccc2Cl)C 62a_100000764095_100153394732 [0,1,1,0,0,0|2,0,0]=4 434 B22R2.27170 COC(=O)COc1cc(cc(c1)Sc2ccccc2Cl)C 62a_100153394732_100000764095 [0,1,1,0,0,0|2,0,0]=4 435 B22R2.27170 COC(=O)COc1cc(cc(c1)Sc2ccccc2F)C 62a_100011215700_100153394732 [0,1,1,0,0,0|2,0,0]=4 436 B22R2.27170 COC(=O)COc1cc(cc(c1)Sc2ccccc2F)C 62a_100153394732_100011215700 [0,1,1,0,0,0|2,0,0]=4 437 B22R2.27170 COC(=O)COc1cc(cc(c1)Sc2ccccc2N)C 62a_100000210017_100153394732 [0,1,1,0,0,0|1,0,1]=4 438 B22R2.27170 COC(=O)COc1cc(cc(c1)Sc2ccccc2N)C 62a_100153394732_100000210017 [0,1,1,0,0,0|1,0,1]=4 439 B22R2.27170 COC(=O)COc1cc(cc(c1)Sc2ccccc2O)C 62a_100000739446_100153394732 [0,1,1,0,0,0|2,0,0]=4 440 B22R2.27170 COC(=O)COc1cc(cc(c1)Sc2ccccc2O)C 62a_100153394732_100000739446 [0,1,1,0,0,0|2,0,0]=4 441 B22R2.28354 C=Cc1ccccc1Sc2cccc(c2)OCC(=O)OC 62a_100011218376_200000148702 [0,1,1,0,0,0|2,0,0]=4 442 B22R2.28354 C=Cc1ccccc1Sc2cccc(c2)OCC(=O)OC 62a_200000148702_100011218376 [0,1,1,0,0,0|2,0,0]=4 443 B22R2.28354 CCc1ccccc1Sc2cccc(c2)OCC(=O)OC 62a_100011215823_200000148702 [0,1,1,0,0,0|2,0,0]=4 444 B22R2.28354 CCc1ccccc1Sc2cccc(c2)OCC(=O)OC 62a_200000148702_100011215823 [0,1,1,0,0,0|2,0,0]=4 445 B22R2.28354 CNc1ccccc1Sc2cccc(c2)OCC(=O)OC 62a_100020606079_200000148702 [0,1,1,0,0,0|1,0,1]=4 446 B22R2.28354 CNc1ccccc1Sc2cccc(c2)OCC(=O)OC 62a_200000148702_100020606079 [0,1,1,0,0,0|1,0,1]=4 447 B22R2.28354 COC(=O)COc1cccc(c1)Sc2ccccc2C#N 62a_200000148702_100000188569 [0,1,1,0,0,0|1,0,1]=4 448 B22R2.28354 COC(=O)COc1cccc(c1)Sc2ccccc2C=O 62a_100000210073_200000148702 [0,1,1,0,0,0|2,0,0]=4 449 B22R2.28354 COC(=O)COc1cccc(c1)Sc2ccccc2C=O 62a_200000148702_100000210073 [0,1,1,0,0,0|2,0,0]=4 450 B22R2.28354 COC(=O)COc1cccc(c1)Sc2ccccc2CN 62a_100000689332_200000148702 [0,1,1,0,0,0|1,0,1]=4 451 B22R2.28354 COC(=O)COc1cccc(c1)Sc2ccccc2CN 62a_200000148702_100000689332 [0,1,1,0,0,0|1,0,1]=4 452 B22R2.28354 COC(=O)COc1cccc(c1)Sc2ccccc2CO 62a_100000187465_200000148702 [0,1,1,0,0,0|2,0,0]=4 453 B22R2.28354 COC(=O)COc1cccc(c1)Sc2ccccc2CO 62a_200000148702_100000187465 [0,1,1,0,0,0|2,0,0]=4 454 B22R2.28354 COC(=O)COc1cccc(c1)Sc2ccccc2NN 62a_100000241748_200000148702 [0,1,1,0,0,0|1,0,1]=4 455 B22R2.28354 COC(=O)COc1cccc(c1)Sc2ccccc2NN 62a_200000148702_100000241748 [0,1,1,0,0,0|1,0,1]=4 456 B22R2.28354 COC(=O)COc1cccc(c1)Sc2ccccc2OC 62a_100000210334_200000148702 [0,1,1,0,0,0|2,0,0]=4 457 B22R2.28354 COC(=O)COc1cccc(c1)Sc2ccccc2OC 62a_200000148702_100000210334 [0,1,1,0,0,0|2,0,0]=4 458 B22R2.28354 COC(=O)COc1cccc(c1)Sc2ccccc2SC 62a_100011217816_200000148702 [0,1,1,0,0,0|2,0,0]=4 459 B22R2.28354 COC(=O)COc1cccc(c1)Sc2ccccc2SC 62a_200000148702_100011217816 [0,1,1,0,0,0|2,0,0]=4 460 B22R2.48681 CCOC(=O)COc1cccc(c1)Sc2ccccc2Br 62a_100000170171_100000695589 [0,1,1,0,0,0|2,0,0]=4 461 B22R2.48681 CCOC(=O)COc1cccc(c1)Sc2ccccc2Br 62a_100000695589_100000170171 [0,1,1,0,0,0|2,0,0]=4 462 B22R2.48681 CCOC(=O)COc1cccc(c1)Sc2ccccc2C 62a_100000170171_100000210755 [0,1,1,0,0,0|2,0,0]=4 463 B22R2.48681 CCOC(=O)COc1cccc(c1)Sc2ccccc2C 62a_100000210755_100000170171 [0,1,1,0,0,0|2,0,0]=4 464 B22R2.48681 CCOC(=O)COc1cccc(c1)Sc2ccccc2Cl 62a_100000170171_100000764095 [0,1,1,0,0,0|2,0,0]=4 465 B22R2.48681 CCOC(=O)COc1cccc(c1)Sc2ccccc2Cl 62a_100000764095_100000170171 [0,1,1,0,0,0|2,0,0]=4 466 B22R2.48681 CCOC(=O)COc1cccc(c1)Sc2ccccc2F 62a_100000170171_100011215700 [0,1,1,0,0,0|2,0,0]=4 467 B22R2.48681 CCOC(=O)COc1cccc(c1)Sc2ccccc2F 62a_100011215700_100000170171 [0,1,1,0,0,0|2,0,0]=4 468 B22R2.48681 CCOC(=O)COc1cccc(c1)Sc2ccccc2N 62a_100000170171_100000210017 [0,1,1,0,0,0|1,0,1]=4 469 B22R2.48681 CCOC(=O)COc1cccc(c1)Sc2ccccc2N 62a_100000210017_100000170171 [0,1,1,0,0,0|1,0,1]=4 470 B22R2.48681 CCOC(=O)COc1cccc(c1)Sc2ccccc2O 62a_100000170171_100000739446 [0,1,1,0,0,0|2,0,0]=4 471 B22R2.48681 CCOC(=O)COc1cccc(c1)Sc2ccccc2O 62a_100000739446_100000170171 [0,1,1,0,0,0|2,0,0]=4 472 B22R2.591270 COC(=O)COc1cccc(c1)Sc2ccc(cc2Br)Br 62a_100011484698_200000148702 [0,1,1,0,0,0|2,0,0]=4 473 B22R2.591270 COC(=O)COc1cccc(c1)Sc2ccc(cc2Br)Br 62a_200000148702_100011484698 [0,1,1,0,0,0|2,0,0]=4 474 B22R2.591270 COC(=O)COc1cccc(c1)Sc2ccc(cc2Br)C 62a_100009813563_200000148702 [0,1,1,0,0,0|2,0,0]=4 475 B22R2.591270 COC(=O)COc1cccc(c1)Sc2ccc(cc2Br)C 62a_200000148702_100009813563 [0,1,1,0,0,0|2,0,0]=4 476 B22R2.591270 COC(=O)COc1cccc(c1)Sc2ccc(cc2Br)Cl 62a_100011219703_200000148702 [0,1,1,0,0,0|2,0,0]=4 477 B22R2.591270 COC(=O)COc1cccc(c1)Sc2ccc(cc2Br)Cl 62a_200000148702_100011219703 [0,1,1,0,0,0|2,0,0]=4 478 B22R2.591270 COC(=O)COc1cccc(c1)Sc2ccc(cc2Br)F 62a_100011217111_200000148702 [0,1,1,0,0,0|2,0,0]=4 479 B22R2.591270 COC(=O)COc1cccc(c1)Sc2ccc(cc2Br)F 62a_200000148702_100011217111 [0,1,1,0,0,0|2,0,0]=4 480 B22R2.591270 COC(=O)COc1cccc(c1)Sc2ccc(cc2Br)N 62a_100000750458_200000148702 [0,1,1,0,0,0|2,0,0]=4 481 B22R2.591270 COC(=O)COc1cccc(c1)Sc2ccc(cc2Br)N 62a_200000148702_100000750458 [0,1,1,0,0,0|2,0,0]=4 482 B22R2.591270 COC(=O)COc1cccc(c1)Sc2ccc(cc2Br)O 62a_100000701344_200000148702 [0,1,1,0,0,0|2,0,0]=4 483 B22R2.591270 COC(=O)COc1cccc(c1)Sc2ccc(cc2Br)O 62a_200000148702_100000701344 [0,1,1,0,0,0|2,0,0]=4 484 B22R2.591270 COC(=O)COc1cccc(c1)Sc2ccc(cc2C)Br 62a_100000701812_200000148702 [0,1,1,0,0,0|2,0,0]=4 485 B22R2.591270 COC(=O)COc1cccc(c1)Sc2ccc(cc2C)Br 62a_200000148702_100000701812 [0,1,1,0,0,0|2,0,0]=4 486 B22R2.591270 COC(=O)COc1cccc(c1)Sc2ccc(cc2C)C 62a_100011217332_200000148702 [0,1,1,0,0,0|2,0,0]=4 487 B22R2.591270 COC(=O)COc1cccc(c1)Sc2ccc(cc2C)C 62a_200000148702_100011217332 [0,1,1,0,0,0|2,0,0]=4 488 B22R2.591270 COC(=O)COc1cccc(c1)Sc2ccc(cc2C)Cl 62a_100011219607_200000148702 [0,1,1,0,0,0|2,0,0]=4 489 B22R2.591270 COC(=O)COc1cccc(c1)Sc2ccc(cc2C)Cl 62a_200000148702_100011219607 [0,1,1,0,0,0|2,0,0]=4 490 B22R2.591270 COC(=O)COc1cccc(c1)Sc2ccc(cc2C)F 62a_100011205405_200000148702 [0,1,1,0,0,0|2,0,0]=4 491 B22R2.591270 COC(=O)COc1cccc(c1)Sc2ccc(cc2C)F 62a_200000148702_100011205405 [0,1,1,0,0,0|2,0,0]=4 492 B22R2.591270 COC(=O)COc1cccc(c1)Sc2ccc(cc2C)N 62a_100000210723_200000148702 [0,1,1,0,0,0|2,0,0]=4 493 B22R2.591270 COC(=O)COc1cccc(c1)Sc2ccc(cc2C)N 62a_200000148702_100000210723 [0,1,1,0,0,0|2,0,0]=4 494 B22R2.591270 COC(=O)COc1cccc(c1)Sc2ccc(cc2C)O 62a_200000148702_100000690111 [0,1,1,0,0,0|2,0,0]=4 495 B22R2.591270 COC(=O)COc1cccc(c1)Sc2ccc(cc2Cl)Br 62a_100011216062_200000148702 [0,1,1,0,0,0|2,0,0]=4 496 B22R2.591270 COC(=O)COc1cccc(c1)Sc2ccc(cc2Cl)Br 62a_200000148702_100011216062 [0,1,1,0,0,0|2,0,0]=4 497 B22R2.591270 COC(=O)COc1cccc(c1)Sc2ccc(cc2Cl)C 62a_100011263221_200000148702 [0,1,1,0,0,0|2,0,0]=4 498 B22R2.591270 COC(=O)COc1cccc(c1)Sc2ccc(cc2Cl)C 62a_200000148702_100011263221 [0,1,1,0,0,0|2,0,0]=4 499 B22R2.591270 COC(=O)COc1cccc(c1)Sc2ccc(cc2Cl)Cl 62a_100000699841_200000148702 [0,1,1,0,0,0|2,0,0]=4 500 B22R2.591270 COC(=O)COc1cccc(c1)Sc2ccc(cc2Cl)Cl 62a_200000148702_100000699841 [0,1,1,0,0,0|2,0,0]=4 501 B22R2.591270 COC(=O)COc1cccc(c1)Sc2ccc(cc2Cl)F 62a_100000733362_200000148702 [0,1,1,0,0,0|2,0,0]=4 502 B22R2.591270 COC(=O)COc1cccc(c1)Sc2ccc(cc2Cl)F 62a_200000148702_100000733362 [0,1,1,0,0,0|2,0,0]=4 503 B22R2.591270 COC(=O)COc1cccc(c1)Sc2ccc(cc2Cl)N 62a_100000761885_200000148702 [0,1,1,0,0,0|2,0,0]=4 504 B22R2.591270 COC(=O)COc1cccc(c1)Sc2ccc(cc2Cl)N 62a_200000148702_100000761885 [0,1,1,0,0,0|2,0,0]=4 505 B22R2.591270 COC(=O)COc1cccc(c1)Sc2ccc(cc2Cl)O 62a_100000047559_200000148702 [0,1,1,0,0,0|2,0,0]=4 506 B22R2.591270 COC(=O)COc1cccc(c1)Sc2ccc(cc2Cl)O 62a_200000148702_100000047559 [0,1,1,0,0,0|2,0,0]=4 507 B22R2.591270 COC(=O)COc1cccc(c1)Sc2ccc(cc2F)Br 62a_100009814013_200000148702 [0,1,1,0,0,0|2,0,0]=4 508 B22R2.591270 COC(=O)COc1cccc(c1)Sc2ccc(cc2F)Br 62a_200000148702_100009814013 [0,1,1,0,0,0|2,0,0]=4 509 B22R2.591270 COC(=O)COc1cccc(c1)Sc2ccc(cc2F)C 62a_100011216119_200000148702 [0,1,1,0,0,0|2,0,0]=4 510 B22R2.591270 COC(=O)COc1cccc(c1)Sc2ccc(cc2F)C 62a_200000148702_100011216119 [0,1,1,0,0,0|2,0,0]=4 511 B22R2.591270 COC(=O)COc1cccc(c1)Sc2ccc(cc2F)Cl 62a_100011216042_200000148702 [0,1,1,0,0,0|2,0,0]=4 512 B22R2.591270 COC(=O)COc1cccc(c1)Sc2ccc(cc2F)Cl 62a_200000148702_100011216042 [0,1,1,0,0,0|2,0,0]=4 513 B22R2.591270 COC(=O)COc1cccc(c1)Sc2ccc(cc2F)F 62a_100000750030_200000148702 [0,1,1,0,0,0|2,0,0]=4 514 B22R2.591270 COC(=O)COc1cccc(c1)Sc2ccc(cc2F)F 62a_200000148702_100000750030 [0,1,1,0,0,0|2,0,0]=4 515 B22R2.591270 COC(=O)COc1cccc(c1)Sc2ccc(cc2F)N 62a_100011356925_200000148702 [0,1,1,0,0,0|2,0,0]=4 516 B22R2.591270 COC(=O)COc1cccc(c1)Sc2ccc(cc2F)N 62a_200000148702_100011356925 [0,1,1,0,0,0|2,0,0]=4 517 B22R2.591270 COC(=O)COc1cccc(c1)Sc2ccc(cc2F)O 62a_100000755031_200000148702 [0,1,1,0,0,0|2,0,0]=4 518 B22R2.591270 COC(=O)COc1cccc(c1)Sc2ccc(cc2F)O 62a_200000148702_100000755031 [0,1,1,0,0,0|2,0,0]=4 519 B22R2.591270 COC(=O)COc1cccc(c1)Sc2ccc(cc2N)Br 62a_100000743836_200000148702 [0,1,1,0,0,0|1,0,1]=4 520 B22R2.591270 COC(=O)COc1cccc(c1)Sc2ccc(cc2N)Br 62a_200000148702_100000743836 [0,1,1,0,0,0|1,0,1]=4 521 B22R2.591270 COC(=O)COc1cccc(c1)Sc2ccc(cc2N)C 62a_100011216686_200000148702 [0,1,1,0,0,0|1,0,1]=4 522 B22R2.591270 COC(=O)COc1cccc(c1)Sc2ccc(cc2N)C 62a_200000148702_100011216686 [0,1,1,0,0,0|1,0,1]=4 523 B22R2.591270 COC(=O)COc1cccc(c1)Sc2ccc(cc2N)Cl 62a_100000761886_200000148702 [0,1,1,0,0,0|1,0,1]=4 524 B22R2.591270 COC(=O)COc1cccc(c1)Sc2ccc(cc2N)Cl 62a_200000148702_100000761886 [0,1,1,0,0,0|1,0,1]=4 525 B22R2.591270 COC(=O)COc1cccc(c1)Sc2ccc(cc2N)F 62a_100000687223_200000148702 [0,1,1,0,0,0|1,0,1]=4 526 B22R2.591270 COC(=O)COc1cccc(c1)Sc2ccc(cc2N)F 62a_200000148702_100000687223 [0,1,1,0,0,0|1,0,1]=4 527 B22R2.591270 COC(=O)COc1cccc(c1)Sc2ccc(cc2N)N 62a_200000148702_200012175722 [0,1,1,0,0,0|1,0,1]=4 528 B22R2.591270 COC(=O)COc1cccc(c1)Sc2ccc(cc2N)N 62a_200012175722_200000148702 [0,1,1,0,0,0|1,0,1]=4 529 B22R2.591270 COC(=O)COc1cccc(c1)Sc2ccc(cc2N)O 62a_100011999798_200000148702 [0,1,1,0,0,0|1,0,1]=4 530 B22R2.591270 COC(=O)COc1cccc(c1)Sc2ccc(cc2N)O 62a_200000148702_100011999798 [0,1,1,0,0,0|1,0,1]=4 531 B22R2.591270 COC(=O)COc1cccc(c1)Sc2ccc(cc2O)Br 62a_100012344904_200000148702 [0,1,1,0,0,0|2,0,0]=4 532 B22R2.591270 COC(=O)COc1cccc(c1)Sc2ccc(cc2O)Br 62a_200000148702_100012344904 [0,1,1,0,0,0|2,0,0]=4 533 B22R2.591270 COC(=O)COc1cccc(c1)Sc2ccc(cc2O)C 62a_100012002257_200000148702 [0,1,1,0,0,0|2,0,0]=4 534 B22R2.591270 COC(=O)COc1cccc(c1)Sc2ccc(cc2O)C 62a_200000148702_100012002257 [0,1,1,0,0,0|2,0,0]=4 535 B22R2.591270 COC(=O)COc1cccc(c1)Sc2ccc(cc2O)Cl 62a_100000050036_200000148702 [0,1,1,0,0,0|2,0,0]=4 536 B22R2.591270 COC(=O)COc1cccc(c1)Sc2ccc(cc2O)Cl 62a_200000148702_100000050036 [0,1,1,0,0,0|2,0,0]=4 537 B22R2.591270 COC(=O)COc1cccc(c1)Sc2ccc(cc2O)F 62a_100000690578_200000148702 [0,1,1,0,0,0|2,0,0]=4 538 B22R2.591270 COC(=O)COc1cccc(c1)Sc2ccc(cc2O)F 62a_200000148702_100000690578 [0,1,1,0,0,0|2,0,0]=4 539 B22R2.591270 COC(=O)COc1cccc(c1)Sc2ccc(cc2O)O 62a_200000148702_100009813921 [0,1,1,0,0,0|2,0,0]=4 540 B22R2.591272 COC(=O)COc1cccc(c1)Sc2cc(ccc2Br)Br 62a_100011483371_200000148702 [0,1,1,0,0,0|2,0,0]=4 541 B22R2.591272 COC(=O)COc1cccc(c1)Sc2cc(ccc2Br)Br 62a_200000148702_100011483371 [0,1,1,0,0,0|2,0,0]=4 542 B22R2.591272 COC(=O)COc1cccc(c1)Sc2cc(ccc2Br)C 62a_100012353751_200000148702 [0,1,1,0,0,0|2,0,0]=4 543 B22R2.591272 COC(=O)COc1cccc(c1)Sc2cc(ccc2Br)C 62a_200000148702_100012353751 [0,1,1,0,0,0|2,0,0]=4 544 B22R2.591272 COC(=O)COc1cccc(c1)Sc2cc(ccc2Br)Cl 62a_100012339723_200000148702 [0,1,1,0,0,0|2,0,0]=4 545 B22R2.591272 COC(=O)COc1cccc(c1)Sc2cc(ccc2Br)Cl 62a_200000148702_100012339723 [0,1,1,0,0,0|2,0,0]=4 546 B22R2.591272 COC(=O)COc1cccc(c1)Sc2cc(ccc2Br)F 62a_100011217576_200000148702 [0,1,1,0,0,0|2,0,0]=4 547 B22R2.591272 COC(=O)COc1cccc(c1)Sc2cc(ccc2Br)F 62a_200000148702_100011217576 [0,1,1,0,0,0|2,0,0]=4 548 B22R2.591272 COC(=O)COc1cccc(c1)Sc2cc(ccc2Br)N 62a_100000750459_200000148702 [0,1,1,0,0,0|2,0,0]=4 549 B22R2.591272 COC(=O)COc1cccc(c1)Sc2cc(ccc2Br)N 62a_200000148702_100000750459 [0,1,1,0,0,0|2,0,0]=4 550 B22R2.591272 COC(=O)COc1cccc(c1)Sc2cc(ccc2Br)O 62a_100012339312_200000148702 [0,1,1,0,0,0|2,0,0]=4 551 B22R2.591272 COC(=O)COc1cccc(c1)Sc2cc(ccc2Br)O 62a_200000148702_100012339312 [0,1,1,0,0,0|2,0,0]=4 552 B22R2.591272 COC(=O)COc1cccc(c1)Sc2cc(ccc2C)Br 62a_100011344865_200000148702 [0,1,1,0,0,0|2,0,0]=4 553 B22R2.591272 COC(=O)COc1cccc(c1)Sc2cc(ccc2C)Br 62a_200000148702_100011344865 [0,1,1,0,0,0|2,0,0]=4 554 B22R2.591272 COC(=O)COc1cccc(c1)Sc2cc(ccc2C)C 62a_100000210833_200000148702 [0,1,1,0,0,0|2,0,0]=4 555 B22R2.591272 COC(=O)COc1cccc(c1)Sc2cc(ccc2C)C 62a_200000148702_100000210833 [0,1,1,0,0,0|2,0,0]=4 556 B22R2.591272 COC(=O)COc1cccc(c1)Sc2cc(ccc2C)Cl 62a_100011263213_200000148702 [0,1,1,0,0,0|2,0,0]=4 557 B22R2.591272 COC(=O)COc1cccc(c1)Sc2cc(ccc2C)Cl 62a_200000148702_100011263213 [0,1,1,0,0,0|2,0,0]=4 558 B22R2.591272 COC(=O)COc1cccc(c1)Sc2cc(ccc2C)F 62a_100011218078_200000148702 [0,1,1,0,0,0|2,0,0]=4 559 B22R2.591272 COC(=O)COc1cccc(c1)Sc2cc(ccc2C)F 62a_200000148702_100011218078 [0,1,1,0,0,0|2,0,0]=4 560 B22R2.591272 COC(=O)COc1cccc(c1)Sc2cc(ccc2C)N 62a_100000736455_200000148702 [0,1,1,0,0,0|2,0,0]=4 561 B22R2.591272 COC(=O)COc1cccc(c1)Sc2cc(ccc2C)N 62a_200000148702_100000736455 [0,1,1,0,0,0|2,0,0]=4 562 B22R2.591272 COC(=O)COc1cccc(c1)Sc2cc(ccc2C)O 62a_100011380479_200000148702 [0,1,1,0,0,0|2,0,0]=4 563 B22R2.591272 COC(=O)COc1cccc(c1)Sc2cc(ccc2C)O 62a_200000148702_100011380479 [0,1,1,0,0,0|2,0,0]=4 564 B22R2.591272 COC(=O)COc1cccc(c1)Sc2cc(ccc2Cl)Br 62a_100011772130_200000148702 [0,1,1,0,0,0|2,0,0]=4 565 B22R2.591272 COC(=O)COc1cccc(c1)Sc2cc(ccc2Cl)Br 62a_200000148702_100011772130 [0,1,1,0,0,0|2,0,0]=4 566 B22R2.591272 COC(=O)COc1cccc(c1)Sc2cc(ccc2Cl)C 62a_100012356289_200000148702 [0,1,1,0,0,0|2,0,0]=4 567 B22R2.591272 COC(=O)COc1cccc(c1)Sc2cc(ccc2Cl)C 62a_200000148702_100012356289 [0,1,1,0,0,0|2,0,0]=4 568 B22R2.591272 COC(=O)COc1cccc(c1)Sc2cc(ccc2Cl)Cl 62a_100000707729_200000148702 [0,1,1,0,0,0|2,0,0]=4 569 B22R2.591272 COC(=O)COc1cccc(c1)Sc2cc(ccc2Cl)Cl 62a_200000148702_100000707729 [0,1,1,0,0,0|2,0,0]=4 570 B22R2.591272 COC(=O)COc1cccc(c1)Sc2cc(ccc2Cl)F 62a_100011217299_200000148702 [0,1,1,0,0,0|2,0,0]=4 571 B22R2.591272 COC(=O)COc1cccc(c1)Sc2cc(ccc2Cl)F 62a_200000148702_100011217299 [0,1,1,0,0,0|2,0,0]=4 572 B22R2.591272 COC(=O)COc1cccc(c1)Sc2cc(ccc2Cl)N 62a_100012360549_200000148702 [0,1,1,0,0,0|2,0,0]=4 573 B22R2.591272 COC(=O)COc1cccc(c1)Sc2cc(ccc2Cl)N 62a_200000148702_100012360549 [0,1,1,0,0,0|2,0,0]=4 574 B22R2.591272 COC(=O)COc1cccc(c1)Sc2cc(ccc2Cl)O 62a_100000049588_200000148702 [0,1,1,0,0,0|2,0,0]=4 575 B22R2.591272 COC(=O)COc1cccc(c1)Sc2cc(ccc2Cl)O 62a_200000148702_100000049588 [0,1,1,0,0,0|2,0,0]=4 576 B22R2.591272 COC(=O)COc1cccc(c1)Sc2cc(ccc2F)Br 62a_100011217312_200000148702 [0,1,1,0,0,0|2,0,0]=4 577 B22R2.591272 COC(=O)COc1cccc(c1)Sc2cc(ccc2F)Br 62a_200000148702_100011217312 [0,1,1,0,0,0|2,0,0]=4 578 B22R2.591272 COC(=O)COc1cccc(c1)Sc2cc(ccc2F)C 62a_100000736223_200000148702 [0,1,1,0,0,0|2,0,0]=4 579 B22R2.591272 COC(=O)COc1cccc(c1)Sc2cc(ccc2F)C 62a_200000148702_100000736223 [0,1,1,0,0,0|2,0,0]=4 580 B22R2.591272 COC(=O)COc1cccc(c1)Sc2cc(ccc2F)Cl 62a_100011218116_200000148702 [0,1,1,0,0,0|2,0,0]=4 581 B22R2.591272 COC(=O)COc1cccc(c1)Sc2cc(ccc2F)Cl 62a_200000148702_100011218116 [0,1,1,0,0,0|2,0,0]=4 582 B22R2.591272 COC(=O)COc1cccc(c1)Sc2cc(ccc2F)F 62a_100011219198_200000148702 [0,1,1,0,0,0|2,0,0]=4 583 B22R2.591272 COC(=O)COc1cccc(c1)Sc2cc(ccc2F)F 62a_200000148702_100011219198 [0,1,1,0,0,0|2,0,0]=4 584 B22R2.591272 COC(=O)COc1cccc(c1)Sc2cc(ccc2F)N 62a_100000760356_200000148702 [0,1,1,0,0,0|2,0,0]=4 585 B22R2.591272 COC(=O)COc1cccc(c1)Sc2cc(ccc2F)N 62a_200000148702_100000760356 [0,1,1,0,0,0|2,0,0]=4 586 B22R2.591272 COC(=O)COc1cccc(c1)Sc2cc(ccc2F)O 62a_100000693481_200000148702 [0,1,1,0,0,0|2,0,0]=4 587 B22R2.591272 COC(=O)COc1cccc(c1)Sc2cc(ccc2F)O 62a_200000148702_100000693481 [0,1,1,0,0,0|2,0,0]=4 588 B22R2.591272 COC(=O)COc1cccc(c1)Sc2cc(ccc2N)Br 62a_100000187925_200000148702 [0,1,1,0,0,0|1,0,1]=4 589 B22R2.591272 COC(=O)COc1cccc(c1)Sc2cc(ccc2N)Br 62a_200000148702_100000187925 [0,1,1,0,0,0|1,0,1]=4 590 B22R2.591272 COC(=O)COc1cccc(c1)Sc2cc(ccc2N)C 62a_100011356834_200000148702 [0,1,1,0,0,0|1,0,1]=4 591 B22R2.591272 COC(=O)COc1cccc(c1)Sc2cc(ccc2N)C 62a_200000148702_100011356834 [0,1,1,0,0,0|1,0,1]=4 592 B22R2.591272 COC(=O)COc1cccc(c1)Sc2cc(ccc2N)Cl 62a_100000761889_200000148702 [0,1,1,0,0,0|1,0,1]=4 593 B22R2.591272 COC(=O)COc1cccc(c1)Sc2cc(ccc2N)Cl 62a_200000148702_100000761889 [0,1,1,0,0,0|1,0,1]=4 594 B22R2.591272 COC(=O)COc1cccc(c1)Sc2cc(ccc2N)F 62a_100000760547_200000148702 [0,1,1,0,0,0|1,0,1]=4 595 B22R2.591272 COC(=O)COc1cccc(c1)Sc2cc(ccc2N)F 62a_200000148702_100000760547 [0,1,1,0,0,0|1,0,1]=4 596 B22R2.591272 COC(=O)COc1cccc(c1)Sc2cc(ccc2N)N 62a_100011534242_200000148702 [0,1,1,0,0,0|1,0,1]=4 597 B22R2.591272 COC(=O)COc1cccc(c1)Sc2cc(ccc2N)N 62a_200000148702_100011534242 [0,1,1,0,0,0|1,0,1]=4 598 B22R2.591272 COC(=O)COc1cccc(c1)Sc2cc(ccc2N)O 62a_100012001276_200000148702 [0,1,1,0,0,0|1,0,1]=4 599 B22R2.591272 COC(=O)COc1cccc(c1)Sc2cc(ccc2N)O 62a_200000148702_100012001276 [0,1,1,0,0,0|1,0,1]=4 600 B22R2.591272 COC(=O)COc1cccc(c1)Sc2cc(ccc2O)Br 62a_100012355227_200000148702 [0,1,1,0,0,0|2,0,0]=4 601 B22R2.591272 COC(=O)COc1cccc(c1)Sc2cc(ccc2O)Br 62a_200000148702_100012355227 [0,1,1,0,0,0|2,0,0]=4 602 B22R2.591272 COC(=O)COc1cccc(c1)Sc2cc(ccc2O)C 62a_100000765521_200000148702 [0,1,1,0,0,0|2,0,0]=4 603 B22R2.591272 COC(=O)COc1cccc(c1)Sc2cc(ccc2O)C 62a_200000148702_100000765521 [0,1,1,0,0,0|2,0,0]=4 604 B22R2.591272 COC(=O)COc1cccc(c1)Sc2cc(ccc2O)Cl 62a_100011356953_200000148702 [0,1,1,0,0,0|2,0,0]=4 605 B22R2.591272 COC(=O)COc1cccc(c1)Sc2cc(ccc2O)Cl 62a_200000148702_100011356953 [0,1,1,0,0,0|2,0,0]=4 606 B22R2.591272 COC(=O)COc1cccc(c1)Sc2cc(ccc2O)F 62a_100000211999_200000148702 [0,1,1,0,0,0|2,0,0]=4 607 B22R2.591272 COC(=O)COc1cccc(c1)Sc2cc(ccc2O)F 62a_200000148702_100000211999 [0,1,1,0,0,0|2,0,0]=4 608 B22R2.591272 COC(=O)COc1cccc(c1)Sc2cc(ccc2O)N 62a_100011534360_200000148702 [0,1,1,0,0,0|2,0,0]=4 609 B22R2.591272 COC(=O)COc1cccc(c1)Sc2cc(ccc2O)N 62a_200000148702_100011534360 [0,1,1,0,0,0|2,0,0]=4 610 B22R2.591272 COC(=O)COc1cccc(c1)Sc2cc(ccc2O)O 62a_200000148702_100009813629 [0,1,1,0,0,0|2,0,0]=4 611 B22R2.591281 COC(=O)COc1cccc(c1)Sc2cccc(c2Br)Br 62a_100010175083_200000148702 [0,1,1,0,0,0|2,0,0]=4 612 B22R2.591281 COC(=O)COc1cccc(c1)Sc2cccc(c2Br)Br 62a_200000148702_100010175083 [0,1,1,0,0,0|2,0,0]=4 613 B22R2.591281 COC(=O)COc1cccc(c1)Sc2cccc(c2Br)C 62a_100012362457_200000148702 [0,1,1,0,0,0|2,0,0]=4 614 B22R2.591281 COC(=O)COc1cccc(c1)Sc2cccc(c2Br)C 62a_200000148702_100012362457 [0,1,1,0,0,0|2,0,0]=4 615 B22R2.591281 COC(=O)COc1cccc(c1)Sc2cccc(c2Br)Cl 62a_100014021842_200000148702 [0,1,1,0,0,0|2,0,0]=4 616 B22R2.591281 COC(=O)COc1cccc(c1)Sc2cccc(c2Br)Cl 62a_200000148702_100014021842 [0,1,1,0,0,0|2,0,0]=4 617 B22R2.591281 COC(=O)COc1cccc(c1)Sc2cccc(c2Br)F 62a_100010202630_200000148702 [0,1,1,0,0,0|2,0,0]=4 618 B22R2.591281 COC(=O)COc1cccc(c1)Sc2cccc(c2Br)F 62a_200000148702_100010202630 [0,1,1,0,0,0|2,0,0]=4 619 B22R2.591281 COC(=O)COc1cccc(c1)Sc2cccc(c2Br)O 62a_100010187914_200000148702 [0,1,1,0,0,0|2,0,0]=4 620 B22R2.591281 COC(=O)COc1cccc(c1)Sc2cccc(c2Br)O 62a_200000148702_100010187914 [0,1,1,0,0,0|2,0,0]=4 621 B22R2.591281 COC(=O)COc1cccc(c1)Sc2cccc(c2C)Br 62a_100012353703_200000148702 [0,1,1,0,0,0|2,0,0]=4 622 B22R2.591281 COC(=O)COc1cccc(c1)Sc2cccc(c2C)Br 62a_200000148702_100012353703 [0,1,1,0,0,0|2,0,0]=4 623 B22R2.591281 COC(=O)COc1cccc(c1)Sc2cccc(c2C)C 62a_100011214922_200000148702 [0,1,1,0,0,0|2,0,0]=4 624 B22R2.591281 COC(=O)COc1cccc(c1)Sc2cccc(c2C)C 62a_200000148702_100011214922 [0,1,1,0,0,0|2,0,0]=4 625 B22R2.591281 COC(=O)COc1cccc(c1)Sc2cccc(c2C)Cl 62a_100000726075_200000148702 [0,1,1,0,0,0|2,0,0]=4 626 B22R2.591281 COC(=O)COc1cccc(c1)Sc2cccc(c2C)Cl 62a_200000148702_100000726075 [0,1,1,0,0,0|2,0,0]=4 627 B22R2.591281 COC(=O)COc1cccc(c1)Sc2cccc(c2C)F 62a_100011216893_200000148702 [0,1,1,0,0,0|2,0,0]=4 628 B22R2.591281 COC(=O)COc1cccc(c1)Sc2cccc(c2C)F 62a_200000148702_100011216893 [0,1,1,0,0,0|2,0,0]=4 629 B22R2.591281 COC(=O)COc1cccc(c1)Sc2cccc(c2C)N 62a_100000761887_200000148702 [0,1,1,0,0,0|2,0,0]=4 630 B22R2.591281 COC(=O)COc1cccc(c1)Sc2cccc(c2C)N 62a_200000148702_100000761887 [0,1,1,0,0,0|2,0,0]=4 631 B22R2.591281 COC(=O)COc1cccc(c1)Sc2cccc(c2C)O 62a_100012002258_200000148702 [0,1,1,0,0,0|2,0,0]=4 632 B22R2.591281 COC(=O)COc1cccc(c1)Sc2cccc(c2C)O 62a_200000148702_100012002258 [0,1,1,0,0,0|2,0,0]=4 633 B22R2.591281 COC(=O)COc1cccc(c1)Sc2cccc(c2Cl)Br 62a_100010142854_200000148702 [0,1,1,0,0,0|2,0,0]=4 634 B22R2.591281 COC(=O)COc1cccc(c1)Sc2cccc(c2Cl)Br 62a_200000148702_100010142854 [0,1,1,0,0,0|2,0,0]=4 635 B22R2.591281 COC(=O)COc1cccc(c1)Sc2cccc(c2Cl)C 62a_200000148702_200012352035 [0,1,1,0,0,0|2,0,0]=4 636 B22R2.591281 COC(=O)COc1cccc(c1)Sc2cccc(c2Cl)C 62a_200012352035_200000148702 [0,1,1,0,0,0|2,0,0]=4 637 B22R2.591281 COC(=O)COc1cccc(c1)Sc2cccc(c2Cl)Cl 62a_100011215384_200000148702 [0,1,1,0,0,0|2,0,0]=4 638 B22R2.591281 COC(=O)COc1cccc(c1)Sc2cccc(c2Cl)Cl 62a_200000148702_100011215384 [0,1,1,0,0,0|2,0,0]=4 639 B22R2.591281 COC(=O)COc1cccc(c1)Sc2cccc(c2Cl)F 62a_200000148702_200010234923 [0,1,1,0,0,0|2,0,0]=4 640 B22R2.591281 COC(=O)COc1cccc(c1)Sc2cccc(c2Cl)F 62a_200010234923_200000148702 [0,1,1,0,0,0|2,0,0]=4 641 B22R2.591281 COC(=O)COc1cccc(c1)Sc2cccc(c2Cl)O 62a_200000148702_100000049636 [0,1,1,0,0,0|2,0,0]=4 642 B22R2.591281 COC(=O)COc1cccc(c1)Sc2cccc(c2F)Br 62a_100000702267_200000148702 [0,1,1,0,0,0|2,0,0]=4 643 B22R2.591281 COC(=O)COc1cccc(c1)Sc2cccc(c2F)Br 62a_200000148702_100000702267 [0,1,1,0,0,0|2,0,0]=4 644 B22R2.591281 COC(=O)COc1cccc(c1)Sc2cccc(c2F)C 62a_100000717567_200000148702 [0,1,1,0,0,0|2,0,0]=4 645 B22R2.591281 COC(=O)COc1cccc(c1)Sc2cccc(c2F)C 62a_200000148702_100000717567 [0,1,1,0,0,0|2,0,0]=4 646 B22R2.591281 COC(=O)COc1cccc(c1)Sc2cccc(c2F)Cl 62a_100011217346_200000148702 [0,1,1,0,0,0|2,0,0]=4 647 B22R2.591281 COC(=O)COc1cccc(c1)Sc2cccc(c2F)Cl 62a_200000148702_100011217346 [0,1,1,0,0,0|2,0,0]=4 648 B22R2.591281 COC(=O)COc1cccc(c1)Sc2cccc(c2F)F 62a_100000694657_200000148702 [0,1,1,0,0,0|2,0,0]=4 649 B22R2.591281 COC(=O)COc1cccc(c1)Sc2cccc(c2F)F 62a_200000148702_100000694657 [0,1,1,0,0,0|2,0,0]=4 650 B22R2.591281 COC(=O)COc1cccc(c1)Sc2cccc(c2F)N 62a_100011935091_200000148702 [0,1,1,0,0,0|2,0,0]=4 651 B22R2.591281 COC(=O)COc1cccc(c1)Sc2cccc(c2F)N 62a_200000148702_100011935091 [0,1,1,0,0,0|2,0,0]=4 652 B22R2.591281 COC(=O)COc1cccc(c1)Sc2cccc(c2F)O 62a_100009817021_200000148702 [0,1,1,0,0,0|2,0,0]=4 653 B22R2.591281 COC(=O)COc1cccc(c1)Sc2cccc(c2F)O 62a_200000148702_100009817021 [0,1,1,0,0,0|2,0,0]=4 654 B22R2.591281 COC(=O)COc1cccc(c1)Sc2cccc(c2N)Br 62a_100010146558_200000148702 [0,1,1,0,0,0|1,0,1]=4 655 B22R2.591281 COC(=O)COc1cccc(c1)Sc2cccc(c2N)Br 62a_200000148702_100010146558 [0,1,1,0,0,0|1,0,1]=4 656 B22R2.591281 COC(=O)COc1cccc(c1)Sc2cccc(c2N)C 62a_100011834072_200000148702 [0,1,1,0,0,0|1,0,1]=4 657 B22R2.591281 COC(=O)COc1cccc(c1)Sc2cccc(c2N)C 62a_200000148702_100011834072 [0,1,1,0,0,0|1,0,1]=4 658 B22R2.591281 COC(=O)COc1cccc(c1)Sc2cccc(c2N)Cl 62a_100010190421_200000148702 [0,1,1,0,0,0|1,0,1]=4 659 B22R2.591281 COC(=O)COc1cccc(c1)Sc2cccc(c2N)Cl 62a_200000148702_100010190421 [0,1,1,0,0,0|1,0,1]=4 660 B22R2.591281 COC(=O)COc1cccc(c1)Sc2cccc(c2N)F 62a_100000042321_200000148702 [0,1,1,0,0,0|1,0,1]=4 661 B22R2.591281 COC(=O)COc1cccc(c1)Sc2cccc(c2N)F 62a_200000148702_100000042321 [0,1,1,0,0,0|1,0,1]=4 662 B22R2.591281 COC(=O)COc1cccc(c1)Sc2cccc(c2N)N 62a_100015191791_200000148702 [0,1,1,0,0,0|1,0,1]=4 663 B22R2.591281 COC(=O)COc1cccc(c1)Sc2cccc(c2N)O 62a_200000148702_100011934926 [0,1,1,0,0,0|1,0,1]=4 664 B22R2.591281 COC(=O)COc1cccc(c1)Sc2cccc(c2O)Br 62a_100010084509_200000148702 [0,1,1,0,0,0|2,0,0]=4 665 B22R2.591281 COC(=O)COc1cccc(c1)Sc2cccc(c2O)Br 62a_200000148702_100010084509 [0,1,1,0,0,0|2,0,0]=4 666 B22R2.591281 COC(=O)COc1cccc(c1)Sc2cccc(c2O)C 62a_100009817157_200000148702 [0,1,1,0,0,0|2,0,0]=4 667 B22R2.591281 COC(=O)COc1cccc(c1)Sc2cccc(c2O)C 62a_200000148702_100009817157 [0,1,1,0,0,0|2,0,0]=4 668 B22R2.591281 COC(=O)COc1cccc(c1)Sc2cccc(c2O)Cl 62a_100010202889_200000148702 [0,1,1,0,0,0|2,0,0]=4 669 B22R2.591281 COC(=O)COc1cccc(c1)Sc2cccc(c2O)Cl 62a_200000148702_100010202889 [0,1,1,0,0,0|2,0,0]=4 670 B22R2.591281 COC(=O)COc1cccc(c1)Sc2cccc(c2O)F 62a_100009813666_200000148702 [0,1,1,0,0,0|2,0,0]=4 671 B22R2.591281 COC(=O)COc1cccc(c1)Sc2cccc(c2O)F 62a_200000148702_100009813666 [0,1,1,0,0,0|2,0,0]=4 672 B22R2.591281 COC(=O)COc1cccc(c1)Sc2cccc(c2O)N 62a_100011934915_200000148702 [0,1,1,0,0,0|2,0,0]=4 673 B22R2.591281 COC(=O)COc1cccc(c1)Sc2cccc(c2O)N 62a_200000148702_100010084371 [0,1,1,0,0,0|2,0,0]=4 674 B22R2.591281 COC(=O)COc1cccc(c1)Sc2cccc(c2O)O 62a_200000148702_100009815950 [0,1,1,0,0,0|2,0,0]=4 675 B22R2.591420 COC(=O)COc1cccc(c1)Nc2c(cccc2C)C 34a_200010220524_100000747449 [0,1,1,0,0,0|1,0,1]=4 676 B22R2.591420 COC(=O)COc1cccc(c1)Nc2c(cccc2C)C 7a_200010220524_100000747449 [0,1,1,0,0,0|1,0,1]=4 677 B22R2.591420 COC(=O)COc1cccc(c1)Sc2c(cccc2Br)Br 62a_100009994525_200000148702 [0,1,1,0,0,0|2,0,0]=4 678 B22R2.591420 COC(=O)COc1cccc(c1)Sc2c(cccc2Br)Br 62a_200000148702_100009994525 [0,1,1,0,0,0|2,0,0]=4 679 B22R2.591420 COC(=O)COc1cccc(c1)Sc2c(cccc2Br)C 62a_100010141302_200000148702 [0,1,1,0,0,0|2,0,0]=4 680 B22R2.591420 COC(=O)COc1cccc(c1)Sc2c(cccc2Br)C 62a_200000148702_100010141302 [0,1,1,0,0,0|2,0,0]=4 681 B22R2.591420 COC(=O)COc1cccc(c1)Sc2c(cccc2Br)Cl 62a_100010214488_200000148702 [0,1,1,0,0,0|2,0,0]=4 682 B22R2.591420 COC(=O)COc1cccc(c1)Sc2c(cccc2Br)Cl 62a_200000148702_100010214488 [0,1,1,0,0,0|2,0,0]=4 683 B22R2.591420 COC(=O)COc1cccc(c1)Sc2c(cccc2Br)F 62a_100011219512_200000148702 [0,1,1,0,0,0|2,0,0]=4 684 B22R2.591420 COC(=O)COc1cccc(c1)Sc2c(cccc2Br)F 62a_200000148702_100011219512 [0,1,1,0,0,0|2,0,0]=4 685 B22R2.591420 COC(=O)COc1cccc(c1)Sc2c(cccc2Br)N 62a_100020590159_200000148702 [0,1,1,0,0,0|1,0,1]=4 686 B22R2.591420 COC(=O)COc1cccc(c1)Sc2c(cccc2Br)N 62a_200000148702_100020590159 [0,1,1,0,0,0|1,0,1]=4 687 B22R2.591420 COC(=O)COc1cccc(c1)Sc2c(cccc2Br)O 62a_100010187912_200000148702 [0,1,1,0,0,0|2,0,0]=4 688 B22R2.591420 COC(=O)COc1cccc(c1)Sc2c(cccc2Br)O 62a_200000148702_100010187912 [0,1,1,0,0,0|2,0,0]=4 689 B22R2.591420 COC(=O)COc1cccc(c1)Sc2c(cccc2C)C 62a_100000033847_200000148702 [0,1,1,0,0,0|2,0,0]=4 690 B22R2.591420 COC(=O)COc1cccc(c1)Sc2c(cccc2C)C 62a_200000148702_100000033847 [0,1,1,0,0,0|2,0,0]=4 691 B22R2.591420 COC(=O)COc1cccc(c1)Sc2c(cccc2Cl)C 62a_100000043165_200000148702 [0,1,1,0,0,0|2,0,0]=4 692 B22R2.591420 COC(=O)COc1cccc(c1)Sc2c(cccc2Cl)C 62a_200000148702_100000043165 [0,1,1,0,0,0|2,0,0]=4 693 B22R2.591420 COC(=O)COc1cccc(c1)Sc2c(cccc2Cl)Cl 62a_100000034237_200000148702 [0,1,1,0,0,0|2,0,0]=4 694 B22R2.591420 COC(=O)COc1cccc(c1)Sc2c(cccc2Cl)Cl 62a_200000148702_100000034237 [0,1,1,0,0,0|2,0,0]=4 695 B22R2.591420 COC(=O)COc1cccc(c1)Sc2c(cccc2Cl)F 62a_100000050007_200000148702 [0,1,1,0,0,0|2,0,0]=4 696 B22R2.591420 COC(=O)COc1cccc(c1)Sc2c(cccc2Cl)F 62a_200000148702_100000050007 [0,1,1,0,0,0|2,0,0]=4 697 B22R2.591420 COC(=O)COc1cccc(c1)Sc2c(cccc2Cl)N 62a_100000049713_200000148702 [0,1,1,0,0,0|1,0,1]=4 698 B22R2.591420 COC(=O)COc1cccc(c1)Sc2c(cccc2Cl)N 62a_200000148702_100000049713 [0,1,1,0,0,0|1,0,1]=4 699 B22R2.591420 COC(=O)COc1cccc(c1)Sc2c(cccc2Cl)O 62a_200000148702_100000050174 [0,1,1,0,0,0|2,0,0]=4 700 B22R2.591420 COC(=O)COc1cccc(c1)Sc2c(cccc2F)C 62a_100011218421_200000148702 [0,1,1,0,0,0|2,0,0]=4 701 B22R2.591420 COC(=O)COc1cccc(c1)Sc2c(cccc2F)C 62a_200000148702_100011218421 [0,1,1,0,0,0|2,0,0]=4 702 B22R2.591420 COC(=O)COc1cccc(c1)Sc2c(cccc2F)F 62a_100000693133_200000148702 [0,1,1,0,0,0|2,0,0]=4 703 B22R2.591420 COC(=O)COc1cccc(c1)Sc2c(cccc2F)F 62a_200000148702_100000693133 [0,1,1,0,0,0|2,0,0]=4 704 B22R2.591420 COC(=O)COc1cccc(c1)Sc2c(cccc2F)N 62a_100000690935_200000148702 [0,1,1,0,0,0|1,0,1]=4 705 B22R2.591420 COC(=O)COc1cccc(c1)Sc2c(cccc2F)N 62a_200000148702_100000690935 [0,1,1,0,0,0|1,0,1]=4 706 B22R2.591420 COC(=O)COc1cccc(c1)Sc2c(cccc2F)O 62a_100009820682_200000148702 [0,1,1,0,0,0|2,0,0]=4 707 B22R2.591420 COC(=O)COc1cccc(c1)Sc2c(cccc2F)O 62a_200000148702_100009820682 [0,1,1,0,0,0|2,0,0]=4 708 B22R2.591420 COC(=O)COc1cccc(c1)Sc2c(cccc2N)C 62a_100000684715_200000148702 [0,1,1,0,0,0|1,0,1]=4 709 B22R2.591420 COC(=O)COc1cccc(c1)Sc2c(cccc2N)C 62a_200000148702_100000684715 [0,1,1,0,0,0|1,0,1]=4 710 B22R2.591420 COC(=O)COc1cccc(c1)Sc2c(cccc2O)C 62a_100000686692_200000148702 [0,1,1,0,0,0|2,0,0]=4 711 B22R2.591420 COC(=O)COc1cccc(c1)Sc2c(cccc2O)C 62a_200000148702_100000686692 [0,1,1,0,0,0|2,0,0]=4 712 B22R2.591420 COC(=O)COc1cccc(c1)Sc2c(cccc2O)N 62a_100012183704_200000148702 [0,1,1,0,0,0|1,0,1]=4 713 B22R2.591420 COC(=O)COc1cccc(c1)Sc2c(cccc2O)N 62a_200000148702_100012183704 [0,1,1,0,0,0|1,0,1]=4 714 B22R2.591420 COC(=O)COc1cccc(c1)Sc2c(cccc2O)O 62a_200000148702_100010205330 [0,1,1,0,0,0|2,0,0]=4 715 B22R2.27099 COC(=O)COc1cc(ccc1Sc2ccccc2Br)F 62a_100000695589_200012936119 [0,1,1,0,0,0|2,0,0]=4 716 B22R2.27099 COC(=O)COc1cc(ccc1Sc2ccccc2Br)F 62a_200012936119_100000695589 [0,1,1,0,0,0|2,0,0]=4 717 B22R2.27099 COC(=O)COc1cc(ccc1Sc2ccccc2C)F 62a_100000210755_200012936119 [0,1,1,0,0,0|2,0,0]=4 718 B22R2.27099 COC(=O)COc1cc(ccc1Sc2ccccc2C)F 62a_200012936119_100000210755 [0,1,1,0,0,0|2,0,0]=4 719 B22R2.27099 COC(=O)COc1cc(ccc1Sc2ccccc2Cl)F 62a_100000764095_200012936119 [0,1,1,0,0,0|2,0,0]=4 720 B22R2.27099 COC(=O)COc1cc(ccc1Sc2ccccc2Cl)F 62a_200012936119_100000764095 [0,1,1,0,0,0|2,0,0]=4 721 B22R2.27099 COC(=O)COc1cc(ccc1Sc2ccccc2F)F 62a_100011215700_200012936119 [0,1,1,0,0,0|2,0,0]=4 722 B22R2.27099 COC(=O)COc1cc(ccc1Sc2ccccc2F)F 62a_200012936119_100011215700 [0,1,1,0,0,0|2,0,0]=4 723 B22R2.27099 COC(=O)COc1cc(ccc1Sc2ccccc2N)F 62a_100000210017_200012936119 [0,1,1,0,0,0|1,0,1]=4 724 B22R2.27099 COC(=O)COc1cc(ccc1Sc2ccccc2N)F 62a_200012936119_100000210017 [0,1,1,0,0,0|1,0,1]=4 725 B22R2.27099 COC(=O)COc1cc(ccc1Sc2ccccc2O)F 62a_100000739446_200012936119 [0,1,1,0,0,0|2,0,0]=4 726 B22R2.27099 COC(=O)COc1cc(ccc1Sc2ccccc2O)F 62a_200012936119_100000739446 [0,1,1,0,0,0|2,0,0]=4 727 B22R2.450686 CCOC(=O)COc1ccccc1Sc2ccccc2Br 62a_100000174061_100000695589 [0,1,1,0,0,0|2,0,0]=4 728 B22R2.450686 CCOC(=O)COc1ccccc1Sc2ccccc2Br 62a_100000695589_100000174061 [0,1,1,0,0,0|2,0,0]=4 729 B22R2.450686 CCOC(=O)COc1ccccc1Sc2ccccc2C 62a_100000174061_100000210755 [0,1,1,0,0,0|2,0,0]=4 730 B22R2.450686 CCOC(=O)COc1ccccc1Sc2ccccc2C 62a_100000210755_100000174061 [0,1,1,0,0,0|2,0,0]=4 731 B22R2.450686 CCOC(=O)COc1ccccc1Sc2ccccc2Cl 62a_100000174061_100000764095 [0,1,1,0,0,0|2,0,0]=4 732 B22R2.450686 CCOC(=O)COc1ccccc1Sc2ccccc2Cl 62a_100000764095_100000174061 [0,1,1,0,0,0|2,0,0]=4 733 B22R2.450686 CCOC(=O)COc1ccccc1Sc2ccccc2F 62a_100000174061_100011215700 [0,1,1,0,0,0|2,0,0]=4 734 B22R2.450686 CCOC(=O)COc1ccccc1Sc2ccccc2F 62a_100011215700_100000174061 [0,1,1,0,0,0|2,0,0]=4 735 B22R2.450686 CCOC(=O)COc1ccccc1Sc2ccccc2N 62a_100000174061_100000210017 [0,1,1,0,0,0|1,0,1]=4 736 B22R2.450686 CCOC(=O)COc1ccccc1Sc2ccccc2N 62a_100000210017_100000174061 [0,1,1,0,0,0|1,0,1]=4 737 B22R2.450686 CCOC(=O)COc1ccccc1Sc2ccccc2O 62a_100000174061_100000739446 [0,1,1,0,0,0|2,0,0]=4 738 B22R2.450686 CCOC(=O)COc1ccccc1Sc2ccccc2O 62a_100000739446_100000174061 [0,1,1,0,0,0|2,0,0]=4 739 B22R2.538022 COC(=O)COc1ccccc1Sc2ccc(cc2Br)Br 62a_100011484698_200000173920 [0,1,1,0,0,0|2,0,0]=4 740 B22R2.538022 COC(=O)COc1ccccc1Sc2ccc(cc2Br)Br 62a_200000173920_100011484698 [0,1,1,0,0,0|2,0,0]=4 741 B22R2.538022 COC(=O)COc1ccccc1Sc2ccc(cc2Br)C 62a_100009813563_200000173920 [0,1,1,0,0,0|2,0,0]=4 742 B22R2.538022 COC(=O)COc1ccccc1Sc2ccc(cc2Br)C 62a_200000173920_100009813563 [0,1,1,0,0,0|2,0,0]=4 743 B22R2.538022 COC(=O)COc1ccccc1Sc2ccc(cc2Br)Cl 62a_100011219703_200000173920 [0,1,1,0,0,0|2,0,0]=4 744 B22R2.538022 COC(=O)COc1ccccc1Sc2ccc(cc2Br)Cl 62a_200000173920_100011219703 [0,1,1,0,0,0|2,0,0]=4 745 B22R2.538022 COC(=O)COc1ccccc1Sc2ccc(cc2Br)F 62a_100011217111_200000173920 [0,1,1,0,0,0|2,0,0]=4 746 B22R2.538022 COC(=O)COc1ccccc1Sc2ccc(cc2Br)F 62a_200000173920_100011217111 [0,1,1,0,0,0|2,0,0]=4 747 B22R2.538022 COC(=O)COc1ccccc1Sc2ccc(cc2Br)N 62a_100000750458_200000173920 [0,1,1,0,0,0|2,0,0]=4 748 B22R2.538022 COC(=O)COc1ccccc1Sc2ccc(cc2Br)N 62a_200000173920_100000750458 [0,1,1,0,0,0|2,0,0]=4 749 B22R2.538022 COC(=O)COc1ccccc1Sc2ccc(cc2Br)O 62a_100000701344_200000173920 [0,1,1,0,0,0|2,0,0]=4 750 B22R2.538022 COC(=O)COc1ccccc1Sc2ccc(cc2Br)O 62a_200000173920_100000701344 [0,1,1,0,0,0|2,0,0]=4 751 B22R2.538022 COC(=O)COc1ccccc1Sc2ccc(cc2C)Br 62a_100000701812_200000173920 [0,1,1,0,0,0|2,0,0]=4 752 B22R2.538022 COC(=O)COc1ccccc1Sc2ccc(cc2C)Br 62a_200000173920_100000701812 [0,1,1,0,0,0|2,0,0]=4 753 B22R2.538022 COC(=O)COc1ccccc1Sc2ccc(cc2C)C 62a_100011217332_200000173920 [0,1,1,0,0,0|2,0,0]=4 754 B22R2.538022 COC(=O)COc1ccccc1Sc2ccc(cc2C)C 62a_200000173920_100011217332 [0,1,1,0,0,0|2,0,0]=4 755 B22R2.538022 COC(=O)COc1ccccc1Sc2ccc(cc2C)Cl 62a_100011219607_200000173920 [0,1,1,0,0,0|2,0,0]=4 756 B22R2.538022 COC(=O)COc1ccccc1Sc2ccc(cc2C)Cl 62a_200000173920_100011219607 [0,1,1,0,0,0|2,0,0]=4 757 B22R2.538022 COC(=O)COc1ccccc1Sc2ccc(cc2C)F 62a_100011205405_200000173920 [0,1,1,0,0,0|2,0,0]=4 758 B22R2.538022 COC(=O)COc1ccccc1Sc2ccc(cc2C)F 62a_200000173920_100011205405 [0,1,1,0,0,0|2,0,0]=4 759 B22R2.538022 COC(=O)COc1ccccc1Sc2ccc(cc2C)N 62a_100000210723_200000173920 [0,1,1,0,0,0|2,0,0]=4 760 B22R2.538022 COC(=O)COc1ccccc1Sc2ccc(cc2C)N 62a_200000173920_100000210723 [0,1,1,0,0,0|2,0,0]=4 761 B22R2.538022 COC(=O)COc1ccccc1Sc2ccc(cc2C)O 62a_200000173920_100000690111 [0,1,1,0,0,0|2,0,0]=4 762 B22R2.538022 COC(=O)COc1ccccc1Sc2ccc(cc2Cl)Br 62a_100011216062_200000173920 [0,1,1,0,0,0|2,0,0]=4 763 B22R2.538022 COC(=O)COc1ccccc1Sc2ccc(cc2Cl)Br 62a_200000173920_100011216062 [0,1,1,0,0,0|2,0,0]=4 764 B22R2.538022 COC(=O)COc1ccccc1Sc2ccc(cc2Cl)C 62a_100011263221_200000173920 [0,1,1,0,0,0|2,0,0]=4 765 B22R2.538022 COC(=O)COc1ccccc1Sc2ccc(cc2Cl)C 62a_200000173920_100011263221 [0,1,1,0,0,0|2,0,0]=4 766 B22R2.538022 COC(=O)COc1ccccc1Sc2ccc(cc2Cl)Cl 62a_100000699841_200000173920 [0,1,1,0,0,0|2,0,0]=4 767 B22R2.538022 COC(=O)COc1ccccc1Sc2ccc(cc2Cl)Cl 62a_200000173920_100000699841 [0,1,1,0,0,0|2,0,0]=4 768 B22R2.538022 COC(=O)COc1ccccc1Sc2ccc(cc2Cl)F 62a_100000733362_200000173920 [0,1,1,0,0,0|2,0,0]=4 769 B22R2.538022 COC(=O)COc1ccccc1Sc2ccc(cc2Cl)F 62a_200000173920_100000733362 [0,1,1,0,0,0|2,0,0]=4 770 B22R2.538022 COC(=O)COc1ccccc1Sc2ccc(cc2Cl)N 62a_100000761885_200000173920 [0,1,1,0,0,0|2,0,0]=4 771 B22R2.538022 COC(=O)COc1ccccc1Sc2ccc(cc2Cl)N 62a_200000173920_100000761885 [0,1,1,0,0,0|2,0,0]=4 772 B22R2.538022 COC(=O)COc1ccccc1Sc2ccc(cc2Cl)O 62a_100000047559_200000173920 [0,1,1,0,0,0|2,0,0]=4 773 B22R2.538022 COC(=O)COc1ccccc1Sc2ccc(cc2Cl)O 62a_200000173920_100000047559 [0,1,1,0,0,0|2,0,0]=4 774 B22R2.538022 COC(=O)COc1ccccc1Sc2ccc(cc2F)Br 62a_100009814013_200000173920 [0,1,1,0,0,0|2,0,0]=4 775 B22R2.538022 COC(=O)COc1ccccc1Sc2ccc(cc2F)Br 62a_200000173920_100009814013 [0,1,1,0,0,0|2,0,0]=4 776 B22R2.538022 COC(=O)COc1ccccc1Sc2ccc(cc2F)C 62a_100011216119_200000173920 [0,1,1,0,0,0|2,0,0]=4 777 B22R2.538022 COC(=O)COc1ccccc1Sc2ccc(cc2F)C 62a_200000173920_100011216119 [0,1,1,0,0,0|2,0,0]=4 778 B22R2.538022 COC(=O)COc1ccccc1Sc2ccc(cc2F)Cl 62a_100011216042_200000173920 [0,1,1,0,0,0|2,0,0]=4 779 B22R2.538022 COC(=O)COc1ccccc1Sc2ccc(cc2F)Cl 62a_200000173920_100011216042 [0,1,1,0,0,0|2,0,0]=4 780 B22R2.538022 COC(=O)COc1ccccc1Sc2ccc(cc2F)F 62a_100000750030_200000173920 [0,1,1,0,0,0|2,0,0]=4 781 B22R2.538022 COC(=O)COc1ccccc1Sc2ccc(cc2F)F 62a_200000173920_100000750030 [0,1,1,0,0,0|2,0,0]=4 782 B22R2.538022 COC(=O)COc1ccccc1Sc2ccc(cc2F)N 62a_100011356925_200000173920 [0,1,1,0,0,0|2,0,0]=4 783 B22R2.538022 COC(=O)COc1ccccc1Sc2ccc(cc2F)N 62a_200000173920_100011356925 [0,1,1,0,0,0|2,0,0]=4 784 B22R2.538022 COC(=O)COc1ccccc1Sc2ccc(cc2F)O 62a_100000755031_200000173920 [0,1,1,0,0,0|2,0,0]=4 785 B22R2.538022 COC(=O)COc1ccccc1Sc2ccc(cc2F)O 62a_200000173920_100000755031 [0,1,1,0,0,0|2,0,0]=4 786 B22R2.538022 COC(=O)COc1ccccc1Sc2ccc(cc2N)Br 62a_100000743836_200000173920 [0,1,1,0,0,0|1,0,1]=4 787 B22R2.538022 COC(=O)COc1ccccc1Sc2ccc(cc2N)Br 62a_200000173920_100000743836 [0,1,1,0,0,0|1,0,1]=4 788 B22R2.538022 COC(=O)COc1ccccc1Sc2ccc(cc2N)C 62a_100011216686_200000173920 [0,1,1,0,0,0|1,0,1]=4 789 B22R2.538022 COC(=O)COc1ccccc1Sc2ccc(cc2N)C 62a_200000173920_100011216686 [0,1,1,0,0,0|1,0,1]=4 790 B22R2.538022 COC(=O)COc1ccccc1Sc2ccc(cc2N)Cl 62a_100000761886_200000173920 [0,1,1,0,0,0|1,0,1]=4 791 B22R2.538022 COC(=O)COc1ccccc1Sc2ccc(cc2N)Cl 62a_200000173920_100000761886 [0,1,1,0,0,0|1,0,1]=4 792 B22R2.538022 COC(=O)COc1ccccc1Sc2ccc(cc2N)F 62a_100000687223_200000173920 [0,1,1,0,0,0|1,0,1]=4 793 B22R2.538022 COC(=O)COc1ccccc1Sc2ccc(cc2N)F 62a_200000173920_100000687223 [0,1,1,0,0,0|1,0,1]=4 794 B22R2.538022 COC(=O)COc1ccccc1Sc2ccc(cc2N)N 62a_200000173920_200012175722 [0,1,1,0,0,0|1,0,1]=4 795 B22R2.538022 COC(=O)COc1ccccc1Sc2ccc(cc2N)N 62a_200012175722_200000173920 [0,1,1,0,0,0|1,0,1]=4 796 B22R2.538022 COC(=O)COc1ccccc1Sc2ccc(cc2N)O 62a_100011999798_200000173920 [0,1,1,0,0,0|1,0,1]=4 797 B22R2.538022 COC(=O)COc1ccccc1Sc2ccc(cc2N)O 62a_200000173920_100011999798 [0,1,1,0,0,0|1,0,1]=4 798 B22R2.538022 COC(=O)COc1ccccc1Sc2ccc(cc2O)Br 62a_100012344904_200000173920 [0,1,1,0,0,0|2,0,0]=4 799 B22R2.538022 COC(=O)COc1ccccc1Sc2ccc(cc2O)Br 62a_200000173920_100012344904 [0,1,1,0,0,0|2,0,0]=4 800 B22R2.538022 COC(=O)COc1ccccc1Sc2ccc(cc2O)C 62a_100012002257_200000173920 [0,1,1,0,0,0|2,0,0]=4 801 B22R2.538022 COC(=O)COc1ccccc1Sc2ccc(cc2O)C 62a_200000173920_100012002257 [0,1,1,0,0,0|2,0,0]=4 802 B22R2.538022 COC(=O)COc1ccccc1Sc2ccc(cc2O)Cl 62a_100000050036_200000173920 [0,1,1,0,0,0|2,0,0]=4 803 B22R2.538022 COC(=O)COc1ccccc1Sc2ccc(cc2O)Cl 62a_200000173920_100000050036 [0,1,1,0,0,0|2,0,0]=4 804 B22R2.538022 COC(=O)COc1ccccc1Sc2ccc(cc2O)F 62a_100000690578_200000173920 [0,1,1,0,0,0|2,0,0]=4 805 B22R2.538022 COC(=O)COc1ccccc1Sc2ccc(cc2O)F 62a_200000173920_100000690578 [0,1,1,0,0,0|2,0,0]=4 806 B22R2.538022 COC(=O)COc1ccccc1Sc2ccc(cc2O)O 62a_200000173920_100009813921 [0,1,1,0,0,0|2,0,0]=4 807 B22R2.538024 COC(=O)COc1ccccc1Sc2cc(ccc2Br)Br 62a_100011483371_200000173920 [0,1,1,0,0,0|2,0,0]=4 808 B22R2.538024 COC(=O)COc1ccccc1Sc2cc(ccc2Br)Br 62a_200000173920_100011483371 [0,1,1,0,0,0|2,0,0]=4 809 B22R2.538024 COC(=O)COc1ccccc1Sc2cc(ccc2Br)C 62a_100012353751_200000173920 [0,1,1,0,0,0|2,0,0]=4 810 B22R2.538024 COC(=O)COc1ccccc1Sc2cc(ccc2Br)C 62a_200000173920_100012353751 [0,1,1,0,0,0|2,0,0]=4 811 B22R2.538024 COC(=O)COc1ccccc1Sc2cc(ccc2Br)Cl 62a_100012339723_200000173920 [0,1,1,0,0,0|2,0,0]=4 812 B22R2.538024 COC(=O)COc1ccccc1Sc2cc(ccc2Br)Cl 62a_200000173920_100012339723 [0,1,1,0,0,0|2,0,0]=4 813 B22R2.538024 COC(=O)COc1ccccc1Sc2cc(ccc2Br)F 62a_100011217576_200000173920 [0,1,1,0,0,0|2,0,0]=4 814 B22R2.538024 COC(=O)COc1ccccc1Sc2cc(ccc2Br)F 62a_200000173920_100011217576 [0,1,1,0,0,0|2,0,0]=4 815 B22R2.538024 COC(=O)COc1ccccc1Sc2cc(ccc2Br)N 62a_100000750459_200000173920 [0,1,1,0,0,0|2,0,0]=4 816 B22R2.538024 COC(=O)COc1ccccc1Sc2cc(ccc2Br)N 62a_200000173920_100000750459 [0,1,1,0,0,0|2,0,0]=4 817 B22R2.538024 COC(=O)COc1ccccc1Sc2cc(ccc2Br)O 62a_100012339312_200000173920 [0,1,1,0,0,0|2,0,0]=4 818 B22R2.538024 COC(=O)COc1ccccc1Sc2cc(ccc2Br)O 62a_200000173920_100012339312 [0,1,1,0,0,0|2,0,0]=4 819 B22R2.538024 COC(=O)COc1ccccc1Sc2cc(ccc2C)Br 62a_100011344865_200000173920 [0,1,1,0,0,0|2,0,0]=4 820 B22R2.538024 COC(=O)COc1ccccc1Sc2cc(ccc2C)Br 62a_200000173920_100011344865 [0,1,1,0,0,0|2,0,0]=4 821 B22R2.538024 COC(=O)COc1ccccc1Sc2cc(ccc2C)C 62a_100000210833_200000173920 [0,1,1,0,0,0|2,0,0]=4 822 B22R2.538024 COC(=O)COc1ccccc1Sc2cc(ccc2C)C 62a_200000173920_100000210833 [0,1,1,0,0,0|2,0,0]=4 823 B22R2.538024 COC(=O)COc1ccccc1Sc2cc(ccc2C)Cl 62a_100011263213_200000173920 [0,1,1,0,0,0|2,0,0]=4 824 B22R2.538024 COC(=O)COc1ccccc1Sc2cc(ccc2C)Cl 62a_200000173920_100011263213 [0,1,1,0,0,0|2,0,0]=4 825 B22R2.538024 COC(=O)COc1ccccc1Sc2cc(ccc2C)F 62a_100011218078_200000173920 [0,1,1,0,0,0|2,0,0]=4 826 B22R2.538024 COC(=O)COc1ccccc1Sc2cc(ccc2C)F 62a_200000173920_100011218078 [0,1,1,0,0,0|2,0,0]=4 827 B22R2.538024 COC(=O)COc1ccccc1Sc2cc(ccc2C)N 62a_100000736455_200000173920 [0,1,1,0,0,0|2,0,0]=4 828 B22R2.538024 COC(=O)COc1ccccc1Sc2cc(ccc2C)N 62a_200000173920_100000736455 [0,1,1,0,0,0|2,0,0]=4 829 B22R2.538024 COC(=O)COc1ccccc1Sc2cc(ccc2C)O 62a_100011380479_200000173920 [0,1,1,0,0,0|2,0,0]=4 830 B22R2.538024 COC(=O)COc1ccccc1Sc2cc(ccc2C)O 62a_200000173920_100011380479 [0,1,1,0,0,0|2,0,0]=4 831 B22R2.538024 COC(=O)COc1ccccc1Sc2cc(ccc2Cl)Br 62a_100011772130_200000173920 [0,1,1,0,0,0|2,0,0]=4 832 B22R2.538024 COC(=O)COc1ccccc1Sc2cc(ccc2Cl)Br 62a_200000173920_100011772130 [0,1,1,0,0,0|2,0,0]=4 833 B22R2.538024 COC(=O)COc1ccccc1Sc2cc(ccc2Cl)C 62a_100012356289_200000173920 [0,1,1,0,0,0|2,0,0]=4 834 B22R2.538024 COC(=O)COc1ccccc1Sc2cc(ccc2Cl)C 62a_200000173920_100012356289 [0,1,1,0,0,0|2,0,0]=4 835 B22R2.538024 COC(=O)COc1ccccc1Sc2cc(ccc2Cl)Cl 62a_100000707729_200000173920 [0,1,1,0,0,0|2,0,0]=4 836 B22R2.538024 COC(=O)COc1ccccc1Sc2cc(ccc2Cl)Cl 62a_200000173920_100000707729 [0,1,1,0,0,0|2,0,0]=4 837 B22R2.538024 COC(=O)COc1ccccc1Sc2cc(ccc2Cl)F 62a_100011217299_200000173920 [0,1,1,0,0,0|2,0,0]=4 838 B22R2.538024 COC(=O)COc1ccccc1Sc2cc(ccc2Cl)F 62a_200000173920_100011217299 [0,1,1,0,0,0|2,0,0]=4 839 B22R2.538024 COC(=O)COc1ccccc1Sc2cc(ccc2Cl)N 62a_100012360549_200000173920 [0,1,1,0,0,0|2,0,0]=4 840 B22R2.538024 COC(=O)COc1ccccc1Sc2cc(ccc2Cl)N 62a_200000173920_100012360549 [0,1,1,0,0,0|2,0,0]=4 841 B22R2.538024 COC(=O)COc1ccccc1Sc2cc(ccc2Cl)O 62a_100000049588_200000173920 [0,1,1,0,0,0|2,0,0]=4 842 B22R2.538024 COC(=O)COc1ccccc1Sc2cc(ccc2Cl)O 62a_200000173920_100000049588 [0,1,1,0,0,0|2,0,0]=4 843 B22R2.538024 COC(=O)COc1ccccc1Sc2cc(ccc2F)Br 62a_100011217312_200000173920 [0,1,1,0,0,0|2,0,0]=4 844 B22R2.538024 COC(=O)COc1ccccc1Sc2cc(ccc2F)Br 62a_200000173920_100011217312 [0,1,1,0,0,0|2,0,0]=4 845 B22R2.538024 COC(=O)COc1ccccc1Sc2cc(ccc2F)C 62a_100000736223_200000173920 [0,1,1,0,0,0|2,0,0]=4 846 B22R2.538024 COC(=O)COc1ccccc1Sc2cc(ccc2F)C 62a_200000173920_100000736223 [0,1,1,0,0,0|2,0,0]=4 847 B22R2.538024 COC(=O)COc1ccccc1Sc2cc(ccc2F)Cl 62a_100011218116_200000173920 [0,1,1,0,0,0|2,0,0]=4 848 B22R2.538024 COC(=O)COc1ccccc1Sc2cc(ccc2F)Cl 62a_200000173920_100011218116 [0,1,1,0,0,0|2,0,0]=4 849 B22R2.538024 COC(=O)COc1ccccc1Sc2cc(ccc2F)F 62a_100011219198_200000173920 [0,1,1,0,0,0|2,0,0]=4 850 B22R2.538024 COC(=O)COc1ccccc1Sc2cc(ccc2F)F 62a_200000173920_100011219198 [0,1,1,0,0,0|2,0,0]=4 851 B22R2.538024 COC(=O)COc1ccccc1Sc2cc(ccc2F)N 62a_100000760356_200000173920 [0,1,1,0,0,0|2,0,0]=4 852 B22R2.538024 COC(=O)COc1ccccc1Sc2cc(ccc2F)N 62a_200000173920_100000760356 [0,1,1,0,0,0|2,0,0]=4 853 B22R2.538024 COC(=O)COc1ccccc1Sc2cc(ccc2F)O 62a_100000693481_200000173920 [0,1,1,0,0,0|2,0,0]=4 854 B22R2.538024 COC(=O)COc1ccccc1Sc2cc(ccc2F)O 62a_200000173920_100000693481 [0,1,1,0,0,0|2,0,0]=4 855 B22R2.538024 COC(=O)COc1ccccc1Sc2cc(ccc2N)Br 62a_100000187925_200000173920 [0,1,1,0,0,0|1,0,1]=4 856 B22R2.538024 COC(=O)COc1ccccc1Sc2cc(ccc2N)Br 62a_200000173920_100000187925 [0,1,1,0,0,0|1,0,1]=4 857 B22R2.538024 COC(=O)COc1ccccc1Sc2cc(ccc2N)C 62a_100011356834_200000173920 [0,1,1,0,0,0|1,0,1]=4 858 B22R2.538024 COC(=O)COc1ccccc1Sc2cc(ccc2N)C 62a_200000173920_100011356834 [0,1,1,0,0,0|1,0,1]=4 859 B22R2.538024 COC(=O)COc1ccccc1Sc2cc(ccc2N)Cl 62a_100000761889_200000173920 [0,1,1,0,0,0|1,0,1]=4 860 B22R2.538024 COC(=O)COc1ccccc1Sc2cc(ccc2N)Cl 62a_200000173920_100000761889 [0,1,1,0,0,0|1,0,1]=4 861 B22R2.538024 COC(=O)COc1ccccc1Sc2cc(ccc2N)F 62a_100000760547_200000173920 [0,1,1,0,0,0|1,0,1]=4 862 B22R2.538024 COC(=O)COc1ccccc1Sc2cc(ccc2N)F 62a_200000173920_100000760547 [0,1,1,0,0,0|1,0,1]=4 863 B22R2.538024 COC(=O)COc1ccccc1Sc2cc(ccc2N)N 62a_100011534242_200000173920 [0,1,1,0,0,0|1,0,1]=4 864 B22R2.538024 COC(=O)COc1ccccc1Sc2cc(ccc2N)N 62a_200000173920_100011534242 [0,1,1,0,0,0|1,0,1]=4 865 B22R2.538024 COC(=O)COc1ccccc1Sc2cc(ccc2N)O 62a_100012001276_200000173920 [0,1,1,0,0,0|1,0,1]=4 866 B22R2.538024 COC(=O)COc1ccccc1Sc2cc(ccc2N)O 62a_200000173920_100012001276 [0,1,1,0,0,0|1,0,1]=4 867 B22R2.538024 COC(=O)COc1ccccc1Sc2cc(ccc2O)Br 62a_100012355227_200000173920 [0,1,1,0,0,0|2,0,0]=4 868 B22R2.538024 COC(=O)COc1ccccc1Sc2cc(ccc2O)Br 62a_200000173920_100012355227 [0,1,1,0,0,0|2,0,0]=4 869 B22R2.538024 COC(=O)COc1ccccc1Sc2cc(ccc2O)C 62a_100000765521_200000173920 [0,1,1,0,0,0|2,0,0]=4 870 B22R2.538024 COC(=O)COc1ccccc1Sc2cc(ccc2O)C 62a_200000173920_100000765521 [0,1,1,0,0,0|2,0,0]=4 871 B22R2.538024 COC(=O)COc1ccccc1Sc2cc(ccc2O)Cl 62a_100011356953_200000173920 [0,1,1,0,0,0|2,0,0]=4 872 B22R2.538024 COC(=O)COc1ccccc1Sc2cc(ccc2O)Cl 62a_200000173920_100011356953 [0,1,1,0,0,0|2,0,0]=4 873 B22R2.538024 COC(=O)COc1ccccc1Sc2cc(ccc2O)F 62a_100000211999_200000173920 [0,1,1,0,0,0|2,0,0]=4 874 B22R2.538024 COC(=O)COc1ccccc1Sc2cc(ccc2O)F 62a_200000173920_100000211999 [0,1,1,0,0,0|2,0,0]=4 875 B22R2.538024 COC(=O)COc1ccccc1Sc2cc(ccc2O)N 62a_100011534360_200000173920 [0,1,1,0,0,0|2,0,0]=4 876 B22R2.538024 COC(=O)COc1ccccc1Sc2cc(ccc2O)N 62a_200000173920_100011534360 [0,1,1,0,0,0|2,0,0]=4 877 B22R2.538024 COC(=O)COc1ccccc1Sc2cc(ccc2O)O 62a_200000173920_100009813629 [0,1,1,0,0,0|2,0,0]=4 878 B22R2.538033 COC(=O)COc1ccccc1Sc2cccc(c2Br)Br 62a_100010175083_200000173920 [0,1,1,0,0,0|2,0,0]=4 879 B22R2.538033 COC(=O)COc1ccccc1Sc2cccc(c2Br)Br 62a_200000173920_100010175083 [0,1,1,0,0,0|2,0,0]=4 880 B22R2.538033 COC(=O)COc1ccccc1Sc2cccc(c2Br)C 62a_100012362457_200000173920 [0,1,1,0,0,0|2,0,0]=4 881 B22R2.538033 COC(=O)COc1ccccc1Sc2cccc(c2Br)C 62a_200000173920_100012362457 [0,1,1,0,0,0|2,0,0]=4 882 B22R2.538033 COC(=O)COc1ccccc1Sc2cccc(c2Br)Cl 62a_100014021842_200000173920 [0,1,1,0,0,0|2,0,0]=4 883 B22R2.538033 COC(=O)COc1ccccc1Sc2cccc(c2Br)Cl 62a_200000173920_100014021842 [0,1,1,0,0,0|2,0,0]=4 884 B22R2.538033 COC(=O)COc1ccccc1Sc2cccc(c2Br)F 62a_100010202630_200000173920 [0,1,1,0,0,0|2,0,0]=4 885 B22R2.538033 COC(=O)COc1ccccc1Sc2cccc(c2Br)F 62a_200000173920_100010202630 [0,1,1,0,0,0|2,0,0]=4 886 B22R2.538033 COC(=O)COc1ccccc1Sc2cccc(c2Br)O 62a_100010187914_200000173920 [0,1,1,0,0,0|2,0,0]=4 887 B22R2.538033 COC(=O)COc1ccccc1Sc2cccc(c2Br)O 62a_200000173920_100010187914 [0,1,1,0,0,0|2,0,0]=4 888 B22R2.538033 COC(=O)COc1ccccc1Sc2cccc(c2C)Br 62a_100012353703_200000173920 [0,1,1,0,0,0|2,0,0]=4 889 B22R2.538033 COC(=O)COc1ccccc1Sc2cccc(c2C)Br 62a_200000173920_100012353703 [0,1,1,0,0,0|2,0,0]=4 890 B22R2.538033 COC(=O)COc1ccccc1Sc2cccc(c2C)C 62a_100011214922_200000173920 [0,1,1,0,0,0|2,0,0]=4 891 B22R2.538033 COC(=O)COc1ccccc1Sc2cccc(c2C)C 62a_200000173920_100011214922 [0,1,1,0,0,0|2,0,0]=4 892 B22R2.538033 COC(=O)COc1ccccc1Sc2cccc(c2C)Cl 62a_100000726075_200000173920 [0,1,1,0,0,0|2,0,0]=4 893 B22R2.538033 COC(=O)COc1ccccc1Sc2cccc(c2C)Cl 62a_200000173920_100000726075 [0,1,1,0,0,0|2,0,0]=4 894 B22R2.538033 COC(=O)COc1ccccc1Sc2cccc(c2C)F 62a_100011216893_200000173920 [0,1,1,0,0,0|2,0,0]=4 895 B22R2.538033 COC(=O)COc1ccccc1Sc2cccc(c2C)F 62a_200000173920_100011216893 [0,1,1,0,0,0|2,0,0]=4 896 B22R2.538033 COC(=O)COc1ccccc1Sc2cccc(c2C)N 62a_100000761887_200000173920 [0,1,1,0,0,0|2,0,0]=4 897 B22R2.538033 COC(=O)COc1ccccc1Sc2cccc(c2C)N 62a_200000173920_100000761887 [0,1,1,0,0,0|2,0,0]=4 898 B22R2.538033 COC(=O)COc1ccccc1Sc2cccc(c2C)O 62a_100012002258_200000173920 [0,1,1,0,0,0|2,0,0]=4 899 B22R2.538033 COC(=O)COc1ccccc1Sc2cccc(c2C)O 62a_200000173920_100012002258 [0,1,1,0,0,0|2,0,0]=4 900 B22R2.538033 COC(=O)COc1ccccc1Sc2cccc(c2Cl)Br 62a_100010142854_200000173920 [0,1,1,0,0,0|2,0,0]=4 901 B22R2.538033 COC(=O)COc1ccccc1Sc2cccc(c2Cl)Br 62a_200000173920_100010142854 [0,1,1,0,0,0|2,0,0]=4 902 B22R2.538033 COC(=O)COc1ccccc1Sc2cccc(c2Cl)C 62a_200000173920_200012352035 [0,1,1,0,0,0|2,0,0]=4 903 B22R2.538033 COC(=O)COc1ccccc1Sc2cccc(c2Cl)C 62a_200012352035_200000173920 [0,1,1,0,0,0|2,0,0]=4 904 B22R2.538033 COC(=O)COc1ccccc1Sc2cccc(c2Cl)Cl 62a_100011215384_200000173920 [0,1,1,0,0,0|2,0,0]=4 905 B22R2.538033 COC(=O)COc1ccccc1Sc2cccc(c2Cl)Cl 62a_200000173920_100011215384 [0,1,1,0,0,0|2,0,0]=4 906 B22R2.538033 COC(=O)COc1ccccc1Sc2cccc(c2Cl)F 62a_200000173920_200010234923 [0,1,1,0,0,0|2,0,0]=4 907 B22R2.538033 COC(=O)COc1ccccc1Sc2cccc(c2Cl)F 62a_200010234923_200000173920 [0,1,1,0,0,0|2,0,0]=4 908 B22R2.538033 COC(=O)COc1ccccc1Sc2cccc(c2Cl)O 62a_200000173920_100000049636 [0,1,1,0,0,0|2,0,0]=4 909 B22R2.538033 COC(=O)COc1ccccc1Sc2cccc(c2F)Br 62a_100000702267_200000173920 [0,1,1,0,0,0|2,0,0]=4 910 B22R2.538033 COC(=O)COc1ccccc1Sc2cccc(c2F)Br 62a_200000173920_100000702267 [0,1,1,0,0,0|2,0,0]=4 911 B22R2.538033 COC(=O)COc1ccccc1Sc2cccc(c2F)C 62a_100000717567_200000173920 [0,1,1,0,0,0|2,0,0]=4 912 B22R2.538033 COC(=O)COc1ccccc1Sc2cccc(c2F)C 62a_200000173920_100000717567 [0,1,1,0,0,0|2,0,0]=4 913 B22R2.538033 COC(=O)COc1ccccc1Sc2cccc(c2F)Cl 62a_100011217346_200000173920 [0,1,1,0,0,0|2,0,0]=4 914 B22R2.538033 COC(=O)COc1ccccc1Sc2cccc(c2F)Cl 62a_200000173920_100011217346 [0,1,1,0,0,0|2,0,0]=4 915 B22R2.538033 COC(=O)COc1ccccc1Sc2cccc(c2F)F 62a_100000694657_200000173920 [0,1,1,0,0,0|2,0,0]=4 916 B22R2.538033 COC(=O)COc1ccccc1Sc2cccc(c2F)F 62a_200000173920_100000694657 [0,1,1,0,0,0|2,0,0]=4 917 B22R2.538033 COC(=O)COc1ccccc1Sc2cccc(c2F)N 62a_100011935091_200000173920 [0,1,1,0,0,0|2,0,0]=4 918 B22R2.538033 COC(=O)COc1ccccc1Sc2cccc(c2F)N 62a_200000173920_100011935091 [0,1,1,0,0,0|2,0,0]=4 919 B22R2.538033 COC(=O)COc1ccccc1Sc2cccc(c2F)O 62a_100009817021_200000173920 [0,1,1,0,0,0|2,0,0]=4 920 B22R2.538033 COC(=O)COc1ccccc1Sc2cccc(c2F)O 62a_200000173920_100009817021 [0,1,1,0,0,0|2,0,0]=4 921 B22R2.538033 COC(=O)COc1ccccc1Sc2cccc(c2N)Br 62a_100010146558_200000173920 [0,1,1,0,0,0|1,0,1]=4 922 B22R2.538033 COC(=O)COc1ccccc1Sc2cccc(c2N)Br 62a_200000173920_100010146558 [0,1,1,0,0,0|1,0,1]=4 923 B22R2.538033 COC(=O)COc1ccccc1Sc2cccc(c2N)C 62a_100011834072_200000173920 [0,1,1,0,0,0|1,0,1]=4 924 B22R2.538033 COC(=O)COc1ccccc1Sc2cccc(c2N)C 62a_200000173920_100011834072 [0,1,1,0,0,0|1,0,1]=4 925 B22R2.538033 COC(=O)COc1ccccc1Sc2cccc(c2N)Cl 62a_100010190421_200000173920 [0,1,1,0,0,0|1,0,1]=4 926 B22R2.538033 COC(=O)COc1ccccc1Sc2cccc(c2N)Cl 62a_200000173920_100010190421 [0,1,1,0,0,0|1,0,1]=4 927 B22R2.538033 COC(=O)COc1ccccc1Sc2cccc(c2N)F 62a_100000042321_200000173920 [0,1,1,0,0,0|1,0,1]=4 928 B22R2.538033 COC(=O)COc1ccccc1Sc2cccc(c2N)F 62a_200000173920_100000042321 [0,1,1,0,0,0|1,0,1]=4 929 B22R2.538033 COC(=O)COc1ccccc1Sc2cccc(c2N)N 62a_100015191791_200000173920 [0,1,1,0,0,0|1,0,1]=4 930 B22R2.538033 COC(=O)COc1ccccc1Sc2cccc(c2N)O 62a_200000173920_100011934926 [0,1,1,0,0,0|1,0,1]=4 931 B22R2.538033 COC(=O)COc1ccccc1Sc2cccc(c2O)Br 62a_100010084509_200000173920 [0,1,1,0,0,0|2,0,0]=4 932 B22R2.538033 COC(=O)COc1ccccc1Sc2cccc(c2O)Br 62a_200000173920_100010084509 [0,1,1,0,0,0|2,0,0]=4 933 B22R2.538033 COC(=O)COc1ccccc1Sc2cccc(c2O)C 62a_100009817157_200000173920 [0,1,1,0,0,0|2,0,0]=4 934 B22R2.538033 COC(=O)COc1ccccc1Sc2cccc(c2O)C 62a_200000173920_100009817157 [0,1,1,0,0,0|2,0,0]=4 935 B22R2.538033 COC(=O)COc1ccccc1Sc2cccc(c2O)Cl 62a_100010202889_200000173920 [0,1,1,0,0,0|2,0,0]=4 936 B22R2.538033 COC(=O)COc1ccccc1Sc2cccc(c2O)Cl 62a_200000173920_100010202889 [0,1,1,0,0,0|2,0,0]=4 937 B22R2.538033 COC(=O)COc1ccccc1Sc2cccc(c2O)F 62a_100009813666_200000173920 [0,1,1,0,0,0|2,0,0]=4 938 B22R2.538033 COC(=O)COc1ccccc1Sc2cccc(c2O)F 62a_200000173920_100009813666 [0,1,1,0,0,0|2,0,0]=4 939 B22R2.538033 COC(=O)COc1ccccc1Sc2cccc(c2O)N 62a_100011934915_200000173920 [0,1,1,0,0,0|2,0,0]=4 940 B22R2.538033 COC(=O)COc1ccccc1Sc2cccc(c2O)N 62a_200000173920_100010084371 [0,1,1,0,0,0|2,0,0]=4 941 B22R2.538033 COC(=O)COc1ccccc1Sc2cccc(c2O)O 62a_200000173920_100009815950 [0,1,1,0,0,0|2,0,0]=4 942 B22R2.592692 COC(=O)COc1ccc(cc1Sc2ccccc2Br)F 62a_100000695589_200000151491 [0,1,1,0,0,0|2,0,0]=4 943 B22R2.592692 COC(=O)COc1ccc(cc1Sc2ccccc2Br)F 62a_200000151491_100000695589 [0,1,1,0,0,0|2,0,0]=4 944 B22R2.592692 COC(=O)COc1ccc(cc1Sc2ccccc2C)F 62a_100000210755_200000151491 [0,1,1,0,0,0|2,0,0]=4 945 B22R2.592692 COC(=O)COc1ccc(cc1Sc2ccccc2C)F 62a_200000151491_100000210755 [0,1,1,0,0,0|2,0,0]=4 946 B22R2.592692 COC(=O)COc1ccc(cc1Sc2ccccc2Cl)F 62a_100000764095_200000151491 [0,1,1,0,0,0|2,0,0]=4 947 B22R2.592692 COC(=O)COc1ccc(cc1Sc2ccccc2Cl)F 62a_200000151491_100000764095 [0,1,1,0,0,0|2,0,0]=4 948 B22R2.592692 COC(=O)COc1ccc(cc1Sc2ccccc2F)F 62a_100011215700_200000151491 [0,1,1,0,0,0|2,0,0]=4 949 B22R2.592692 COC(=O)COc1ccc(cc1Sc2ccccc2F)F 62a_200000151491_100011215700 [0,1,1,0,0,0|2,0,0]=4 950 B22R2.592692 COC(=O)COc1ccc(cc1Sc2ccccc2N)F 62a_100000210017_200000151491 [0,1,1,0,0,0|1,0,1]=4 951 B22R2.592692 COC(=O)COc1ccc(cc1Sc2ccccc2N)F 62a_200000151491_100000210017 [0,1,1,0,0,0|1,0,1]=4 952 B22R2.592692 COC(=O)COc1ccc(cc1Sc2ccccc2O)F 62a_100000739446_200000151491 [0,1,1,0,0,0|2,0,0]=4 953 B22R2.592692 COC(=O)COc1ccc(cc1Sc2ccccc2O)F 62a_200000151491_100000739446 [0,1,1,0,0,0|2,0,0]=4 954 B22R2.637984 C=Cc1ccccc1Sc2ccccc2OCC(=O)OC 62a_100011218376_200000173920 [0,1,1,0,0,0|2,0,0]=4 955 B22R2.637984 C=Cc1ccccc1Sc2ccccc2OCC(=O)OC 62a_200000173920_100011218376 [0,1,1,0,0,0|2,0,0]=4 956 B22R2.637984 CCc1ccccc1Sc2ccccc2OCC(=O)OC 62a_100011215823_200000173920 [0,1,1,0,0,0|2,0,0]=4 957 B22R2.637984 CCc1ccccc1Sc2ccccc2OCC(=O)OC 62a_200000173920_100011215823 [0,1,1,0,0,0|2,0,0]=4 958 B22R2.637984 CNc1ccccc1Sc2ccccc2OCC(=O)OC 62a_100020606079_200000173920 [0,1,1,0,0,0|1,0,1]=4 959 B22R2.637984 CNc1ccccc1Sc2ccccc2OCC(=O)OC 62a_200000173920_100020606079 [0,1,1,0,0,0|1,0,1]=4 960 B22R2.637984 COC(=O)COc1ccccc1Sc2ccccc2C#N 62a_200000173920_100000188569 [0,1,1,0,0,0|1,0,1]=4 961 B22R2.637984 COC(=O)COc1ccccc1Sc2ccccc2C=O 62a_100000210073_200000173920 [0,1,1,0,0,0|2,0,0]=4 962 B22R2.637984 COC(=O)COc1ccccc1Sc2ccccc2C=O 62a_200000173920_100000210073 [0,1,1,0,0,0|2,0,0]=4 963 B22R2.637984 COC(=O)COc1ccccc1Sc2ccccc2CN 62a_100000689332_200000173920 [0,1,1,0,0,0|1,0,1]=4 964 B22R2.637984 COC(=O)COc1ccccc1Sc2ccccc2CN 62a_200000173920_100000689332 [0,1,1,0,0,0|1,0,1]=4 965 B22R2.637984 COC(=O)COc1ccccc1Sc2ccccc2CO 62a_100000187465_200000173920 [0,1,1,0,0,0|2,0,0]=4 966 B22R2.637984 COC(=O)COc1ccccc1Sc2ccccc2CO 62a_200000173920_100000187465 [0,1,1,0,0,0|2,0,0]=4 967 B22R2.637984 COC(=O)COc1ccccc1Sc2ccccc2NN 62a_100000241748_200000173920 [0,1,1,0,0,0|1,0,1]=4 968 B22R2.637984 COC(=O)COc1ccccc1Sc2ccccc2NN 62a_200000173920_100000241748 [0,1,1,0,0,0|1,0,1]=4 969 B22R2.637984 COC(=O)COc1ccccc1Sc2ccccc2OC 62a_100000210334_200000173920 [0,1,1,0,0,0|2,0,0]=4 970 B22R2.637984 COC(=O)COc1ccccc1Sc2ccccc2OC 62a_200000173920_100000210334 [0,1,1,0,0,0|2,0,0]=4 971 B22R2.637984 COC(=O)COc1ccccc1Sc2ccccc2SC 62a_100011217816_200000173920 [0,1,1,0,0,0|2,0,0]=4 972 B22R2.637984 COC(=O)COc1ccccc1Sc2ccccc2SC 62a_200000173920_100011217816 [0,1,1,0,0,0|2,0,0]=4 973 B22R2.8344605 COC(=O)COc1ccccc1Sc2c(cccc2Br)Br 62a_100009994525_200000173920 [0,1,1,0,0,0|2,0,0]=4 974 B22R2.8344605 COC(=O)COc1ccccc1Sc2c(cccc2Br)Br 62a_200000173920_100009994525 [0,1,1,0,0,0|2,0,0]=4 975 B22R2.8344605 COC(=O)COc1ccccc1Sc2c(cccc2Br)C 62a_100010141302_200000173920 [0,1,1,0,0,0|2,0,0]=4 976 B22R2.8344605 COC(=O)COc1ccccc1Sc2c(cccc2Br)C 62a_200000173920_100010141302 [0,1,1,0,0,0|2,0,0]=4 977 B22R2.8344605 COC(=O)COc1ccccc1Sc2c(cccc2Br)Cl 62a_100010214488_200000173920 [0,1,1,0,0,0|2,0,0]=4 978 B22R2.8344605 COC(=O)COc1ccccc1Sc2c(cccc2Br)Cl 62a_200000173920_100010214488 [0,1,1,0,0,0|2,0,0]=4 979 B22R2.8344605 COC(=O)COc1ccccc1Sc2c(cccc2Br)F 62a_100011219512_200000173920 [0,1,1,0,0,0|2,0,0]=4 980 B22R2.8344605 COC(=O)COc1ccccc1Sc2c(cccc2Br)F 62a_200000173920_100011219512 [0,1,1,0,0,0|2,0,0]=4 981 B22R2.8344605 COC(=O)COc1ccccc1Sc2c(cccc2Br)N 62a_100020590159_200000173920 [0,1,1,0,0,0|1,0,1]=4 982 B22R2.8344605 COC(=O)COc1ccccc1Sc2c(cccc2Br)N 62a_200000173920_100020590159 [0,1,1,0,0,0|1,0,1]=4 983 B22R2.8344605 COC(=O)COc1ccccc1Sc2c(cccc2Br)O 62a_100010187912_200000173920 [0,1,1,0,0,0|2,0,0]=4 984 B22R2.8344605 COC(=O)COc1ccccc1Sc2c(cccc2Br)O 62a_200000173920_100010187912 [0,1,1,0,0,0|2,0,0]=4 985 B22R2.8344605 COC(=O)COc1ccccc1Sc2c(cccc2C)C 62a_100000033847_200000173920 [0,1,1,0,0,0|2,0,0]=4 986 B22R2.8344605 COC(=O)COc1ccccc1Sc2c(cccc2C)C 62a_200000173920_100000033847 [0,1,1,0,0,0|2,0,0]=4 987 B22R2.8344605 COC(=O)COc1ccccc1Sc2c(cccc2Cl)C 62a_100000043165_200000173920 [0,1,1,0,0,0|2,0,0]=4 988 B22R2.8344605 COC(=O)COc1ccccc1Sc2c(cccc2Cl)C 62a_200000173920_100000043165 [0,1,1,0,0,0|2,0,0]=4 989 B22R2.8344605 COC(=O)COc1ccccc1Sc2c(cccc2Cl)Cl 62a_100000034237_200000173920 [0,1,1,0,0,0|2,0,0]=4 990 B22R2.8344605 COC(=O)COc1ccccc1Sc2c(cccc2Cl)Cl 62a_200000173920_100000034237 [0,1,1,0,0,0|2,0,0]=4 991 B22R2.8344605 COC(=O)COc1ccccc1Sc2c(cccc2Cl)F 62a_100000050007_200000173920 [0,1,1,0,0,0|2,0,0]=4 992 B22R2.8344605 COC(=O)COc1ccccc1Sc2c(cccc2Cl)F 62a_200000173920_100000050007 [0,1,1,0,0,0|2,0,0]=4 993 B22R2.8344605 COC(=O)COc1ccccc1Sc2c(cccc2Cl)N 62a_100000049713_200000173920 [0,1,1,0,0,0|1,0,1]=4 994 B22R2.8344605 COC(=O)COc1ccccc1Sc2c(cccc2Cl)N 62a_200000173920_100000049713 [0,1,1,0,0,0|1,0,1]=4 995 B22R2.8344605 COC(=O)COc1ccccc1Sc2c(cccc2Cl)O 62a_200000173920_100000050174 [0,1,1,0,0,0|2,0,0]=4 996 B22R2.8344605 COC(=O)COc1ccccc1Sc2c(cccc2F)C 62a_100011218421_200000173920 [0,1,1,0,0,0|2,0,0]=4 997 B22R2.8344605 COC(=O)COc1ccccc1Sc2c(cccc2F)C 62a_200000173920_100011218421 [0,1,1,0,0,0|2,0,0]=4 998 B22R2.8344605 COC(=O)COc1ccccc1Sc2c(cccc2F)F 62a_100000693133_200000173920 [0,1,1,0,0,0|2,0,0]=4 999 B22R2.8344605 COC(=O)COc1ccccc1Sc2c(cccc2F)F 62a_200000173920_100000693133 [0,1,1,0,0,0|2,0,0]=4 1000 B22R2.8344605 COC(=O)COc1ccccc1Sc2c(cccc2F)N 62a_100000690935_200000173920 [0,1,1,0,0,0|1,0,1]=4 1001 B22R2.8344605 COC(=O)COc1ccccc1Sc2c(cccc2F)N 62a_200000173920_100000690935 [0,1,1,0,0,0|1,0,1]=4 1002 B22R2.8344605 COC(=O)COc1ccccc1Sc2c(cccc2F)O 62a_100009820682_200000173920 [0,1,1,0,0,0|2,0,0]=4 1003 B22R2.8344605 COC(=O)COc1ccccc1Sc2c(cccc2F)O 62a_200000173920_100009820682 [0,1,1,0,0,0|2,0,0]=4 1004 B22R2.8344605 COC(=O)COc1ccccc1Sc2c(cccc2N)C 62a_100000684715_200000173920 [0,1,1,0,0,0|1,0,1]=4 1005 B22R2.8344605 COC(=O)COc1ccccc1Sc2c(cccc2N)C 62a_200000173920_100000684715 [0,1,1,0,0,0|1,0,1]=4 1006 B22R2.8344605 COC(=O)COc1ccccc1Sc2c(cccc2O)C 62a_100000686692_200000173920 [0,1,1,0,0,0|2,0,0]=4 1007 B22R2.8344605 COC(=O)COc1ccccc1Sc2c(cccc2O)C 62a_200000173920_100000686692 [0,1,1,0,0,0|2,0,0]=4 1008 B22R2.8344605 COC(=O)COc1ccccc1Sc2c(cccc2O)N 62a_100012183704_200000173920 [0,1,1,0,0,0|1,0,1]=4 1009 B22R2.8344605 COC(=O)COc1ccccc1Sc2c(cccc2O)N 62a_200000173920_100012183704 [0,1,1,0,0,0|1,0,1]=4 1010 B22R2.8344605 COC(=O)COc1ccccc1Sc2c(cccc2O)O 62a_200000173920_100010205330 [0,1,1,0,0,0|2,0,0]=4 1011 B22R3.76989 COCCNc1cccc2c1nc3c(n2)cc(cc3)Cl 27a_100000209980_100160470743 [1,1,0,0,0,0|1,0,1]=4 1012 B22R3.2111995 C/C=C/CC(=O)c1cccc2c1nc3c(n2)cccc3 1458a_200016989829_100102629194 [1,1,0,0,0,0|2,0,0]=4 1013 B22R3.2111995 CC=CCC(=O)c1cccc2c1nc3c(n2)cccc3 1458a_200016989829_100000070051 [1,1,0,0,0,0|2,0,0]=4 1014 B22R3.2111995 COCCC(=O)c1cccc2c1nc3c(n2)cccc3 1458a_200016989829_100000233755 [1,1,0,0,0,0|1,0,1]=4 1015 B22R3.2111995 COCCN(C)c1cccc2c1nc3c(n2)cccc3 27a_100000743101_100010275551 [1,1,0,0,0,0|1,0,1]=4 1016 B22R3.3075892 COCCNc1cccc2c1nc3c(n2)ccc(c3)Cl 27a_100000209980_100160470744 [1,1,0,0,0,0|1,0,1]=4 1017 B22R3.5361390 C=COCCOc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100000039644 [1,1,0,0,0,0|0,0,2]=4 1018 B22R3.5361390 CC/C=C\COc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100103147603 [1,1,0,0,0,0|1,0,0]=3 1019 B22R3.5361390 CCC#CCOc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100009813939 [1,1,0,0,0,0|1,0,1]=4 1020 B22R3.5361390 CCCCCOc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100000718602 [1,1,0,0,0,0|1,0,1]=4 1021 B22R3.5361390 CCOCCNc1cccc2c1nc3c(n2)cccc3 27a_100011200944_100010275551 [1,1,0,0,0,0|1,0,1]=4 1022 B22R3.5361390 CCOCCOc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100000210147 [1,1,0,0,0,0|0,0,1]=3 1023 B22R3.5361390 CCSCCOc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100000757381 [1,1,0,0,0,0|0,1,1]=4 1024 B22R3.5361390 COCCCNc1cccc2c1nc3c(n2)cccc3 27a_100150723488_100010275551 [1,1,0,0,0,0|1,0,1]=4 1025 B22R3.5361390 COCCCOc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100000740836 [1,1,0,0,0,0|0,0,1]=3 1026 B22R3.5361390 FCCCCOc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100000729493 [1,1,0,0,0,0|1,0,1]=4 1027 B22R3.5361390 OCC#CCOc1cccc2c1nc3c(n2)cccc3 34a_100000029702_200000047223 [1,1,0,0,0,0|1,0,1]=4 1028 B22R3.5361390 OCCCCOc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100011216708 [1,1,0,0,0,0|1,0,1]=4 1029 B22R3.12388393 C=C(C)CCOc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100000730704 [1,1,0,0,0,0|1,0,1]=4 1030 B22R3.12388393 CC(=CCNc1cccc2c1nc3c(n2)cccc3)C 27a_100000718196_100010275551 [1,1,0,0,0,0|2,0,0]=4 1031 B22R3.12388393 CC(=CCOc1cccc2c1nc3c(n2)cccc3)C 34a_100000029702_100000761012 [1,1,0,0,0,0|1,0,0]=3 1032 B22R3.12388393 CC(=O)OCOc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100009813279 [1,1,0,0,0,0|2,0,0]=4 1033 B22R3.12388393 CC(C)CCOc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100000210312 [1,1,0,0,0,0|1,0,1]=4 1034 B22R3.12388393 CC(C)OCOc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100000709892 [1,1,0,0,0,0|2,0,0]=4 1035 B22R3.12388393 CC(O)CCOc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100012276601 [1,1,0,0,0,0|1,0,1]=4 1036 B22R3.13467872 CCCC(C)Oc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100000766640 [1,1,0,0,0,0|1,0,1]=4 1037 B22R3.13467872 COCC(C)Oc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100000765312 [1,1,0,0,0,0|0,0,1]=3 1038 B22R3.13467872 COC[C@@H](C)Nc1cccc2c1nc3c(n2)cccc3 27a_100000764878_100010275551 [1,1,0,0,0,0|1,0,1]=4 1039 B22R3.23870570 COCCNc1cccc2c1nc3c(n2)cccc3Cl 27a_100000209980_100160470748 [1,1,0,0,0,0|1,0,1]=4 1040 B22R3.5488411 C=C(C)CNc1cccc2c1nc3c(n2)ccc(c3)Cl 27a_100000765925_100160470744 [1,1,0,0,0,0|2,0,0]=4 1041 B22R3.23425027 CC(Oc1cccc2c1nc3c(n2)cccc3)C(=O)N 34a_100000029702_100000702099 [1,1,0,0,0,0|1,0,0]=3 1042 B22R3.23425027 C[C@@H](Nc1cccc2c1nc3c(n2)cccc3)C(=O)N 27a_100000119354_100010275551 [1,1,0,0,0,0|2,0,0]=4 1043 B22R3.23425027 NC(=O)C(F)Oc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100009813875 [1,1,0,0,0,0|1,0,0]=3 1044 B22R3.23425027 O=C([O-])C(F)Oc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100020610796 [1,1,0,0,0,0|0,0,1]=3 1045 B22R3.25083497 CC(C)(C)COc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100011219605 [1,1,0,0,0,0|1,0,1]=4 1046 B22R3.25083497 CC(C)(F)COc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100011997219 [1,1,0,0,0,0|1,0,1]=4 1047 B22R3.25083497 CC(C)(O)COc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100000764493 [1,1,0,0,0,0|0,0,2]=4 1048 B22R3.25083497 O=S(=O)([O-])COc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100009817235 [1,1,0,0,0,0|1,0,1]=4 1049 B22R3.41084420 C=C(C)CC(=O)c1cccc2c1nc3c(n2)cccc3 1458a_200016989829_100000748629 [1,1,0,0,0,0|2,0,0]=4 1050 B22R3.41084420 C=C(C)CN(C)c1cccc2c1nc3c(n2)cccc3 27a_100000225649_100010275551 [1,1,0,0,0,0|2,0,0]=4 1051 B22R3.41084420 CN(CC(=O)N)c1cccc2c1nc3c(n2)cccc3 27a_100000739694_100010275551 [1,1,0,0,0,0|2,0,0]=4 1052 B22R3.41084420 NC(=O)CC(=O)c1cccc2c1nc3c(n2)cccc3 1458a_200016989829_100000187820 [1,1,0,0,0,0|2,0,0]=4 1053 B22R3.41084420 O=C([O-])CC(=O)c1cccc2c1nc3c(n2)cccc3 1458a_200016989829_100020667443 [1,1,0,0,0,0|1,0,1]=4 1054 B22R3.51393501 C=C(C)CNc1cccc2c1nc3c(n2)cc(cc3)Cl 27a_100000765925_100160470743 [1,1,0,0,0,0|2,0,0]=4 1055 B22R3.71894206 C=C(C)CNc1cccc2c1nc3c(n2)cccc3Cl 27a_100000765925_100160470748 [1,1,0,0,0,0|2,0,0]=4 1056 B22R3.857654 COC(=O)CC(=O)c1cccc-2c1Cc3c2cccc3 1458a_100000033212_100000747449 [0,1,0,0,1,0|2,0,0]=4 1057 B22R3.857654 COC(=O)CC(=O)c1cccc2c1oc3c2cccc3 1458a_100000022655_100000747449 [0,1,0,0,1,0|2,0,0]=4 1058 B22R3.857654 COC(=O)CC(=O)c1cccc2c1sc3c2cccc3 1458a_100009992642_100000747449 [0,1,0,0,1,0|2,0,0]=4 1059 B22R3.1391249 C=COC(=O)COc1cccc2c1oc3c2cccc3 34a_100010256078_100000036128 [0,1,0,0,1,0|1,0,1]=4 1060 B22R3.1391249 CCCC(=O)COc1cccc2c1oc3c2cccc3 7a_100010256078_100000747444 [0,1,0,0,1,0|2,0,0]=4 1061 B22R3.1391249 CCNC(=O)COc1cccc2c1oc3c2cccc3 34a_100010256078_100000183381 [0,1,0,0,1,0|2,0,0]=4 1062 B22R3.1391249 CCNC(=O)COc1cccc2c1oc3c2cccc3 7a_100010256078_100000183381 [0,1,0,0,1,0|2,0,0]=4 1063 B22R3.1391249 CCOC(=O)CNc1cccc2c1oc3c2cccc3 34a_200000102501_100000188475 [0,1,0,0,1,0|2,0,0]=4 1064 B22R3.1391249 CCOC(=O)COc1cccc2c1oc3c2cccc3 34a_100010256078_100000188475 [0,1,0,0,1,0|1,0,0]=3 1065 B22R3.1391249 CCOC(=O)COc1cccc2c1oc3c2cccc3 7a_100010256078_100000188475 [0,1,0,0,1,0|1,0,0]=3 1066 B22R3.1391249 O=C(COc1cccc2c1oc3c2cccc3)NCO 34a_100010256078_100000185155 [0,1,0,0,1,0|2,0,0]=4 1067 B22R3.1391249 O=C(COc1cccc2c1oc3c2cccc3)NCO 7a_100010256078_100000185155 [0,1,0,0,1,0|2,0,0]=4 1068 B22R3.1404575 CCC(=O)C(C)Oc1cccc2c1oc3c2cccc3 7a_100010256078_100000742827 [0,1,0,0,1,0|2,0,0]=4 1069 B22R3.1404575 CNC(=O)C(C)Oc1cccc2c1oc3c2cccc3 34a_100010256078_100000731044 [0,1,0,0,1,0|2,0,0]=4 1070 B22R3.1404575 CNC(=O)C(C)Oc1cccc2c1oc3c2cccc3 7a_100010256078_100000209862 [0,1,0,0,1,0|2,0,0]=4 1071 B22R3.1404575 CNC(=O)C(F)Oc1cccc2c1oc3c2cccc3 34a_100010256078_100009813575 [0,1,0,0,1,0|2,0,0]=4 1072 B22R3.1404575 CNC(=O)C(F)Oc1cccc2c1oc3c2cccc3 7a_100010256078_100009813575 [0,1,0,0,1,0|2,0,0]=4 1073 B22R3.1404575 COC(=O)C(C)Nc1cccc2c1oc3c2cccc3 34a_200000102501_100000211248 [0,1,0,0,1,0|2,0,0]=4 1074 B22R3.1404575 COC(=O)C(C)Oc1cccc2c1oc3c2cccc3 34a_100010256078_100000211248 [0,1,0,0,1,0|1,0,0]=3 1075 B22R3.1404575 COC(=O)C(C)Oc1cccc2c1oc3c2cccc3 7a_100010256078_100000211248 [0,1,0,0,1,0|1,0,0]=3 1076 B22R3.3018624 CC(=O)C(=O)COc1cccc2c1oc3c2cccc3 34a_100010256078_100011261029 [0,1,0,0,1,0|2,0,0]=4 1077 B22R3.3018624 CC(C)C(=O)COc1cccc2c1oc3c2cccc3 34a_100010256078_100000753385 [0,1,0,0,1,0|2,0,0]=4 1078 B22R3.3018624 CC(C)C(=O)COc1cccc2c1oc3c2cccc3 7a_100010256078_100000753385 [0,1,0,0,1,0|2,0,0]=4 1079 B22R3.3018624 CN(C)C(=O)COc1cccc2c1oc3c2cccc3 34a_100010256078_100000692301 [0,1,0,0,1,0|2,0,0]=4 1080 B22R3.3018624 CN(C)C(=O)COc1cccc2c1oc3c2cccc3 7a_100010256078_100000692301 [0,1,0,0,1,0|2,0,0]=4 1081 B22R3.15513320 CCC(=O)COc1cccc2c1oc3c2cc(cc3)F 7a_100160571805_100000747405 [0,1,0,0,1,0|2,0,0]=4 1082 B22R3.15513320 CNC(=O)COc1cccc2c1oc3c2cc(cc3)F 34a_100160571805_100000183359 [0,1,0,0,1,0|2,0,0]=4 1083 B22R3.15513320 CNC(=O)COc1cccc2c1oc3c2cc(cc3)F 7a_100160571805_100000183359 [0,1,0,0,1,0|2,0,0]=4 1084 B22R3.15513320 COC(=O)COc1cccc2c1oc3c2cc(cc3)F 34a_100160571805_100000747449 [0,1,0,0,1,0|1,0,0]=3 1085 B22R3.15513320 COC(=O)COc1cccc2c1oc3c2cc(cc3)F 7a_100160571805_100000747449 [0,1,0,0,1,0|1,0,0]=3 1086 B22R3.15513378 COC(=O)CSc1cccc-2c1C(=O)c3c2cccc3 62a_100010704374_100000747449 [0,1,0,0,1,0|1,1,0]=4 1087 B22R3.1043154 COC(=O)CSc1cccc2c1-c3ccccc3C2=O 62a_100010741556_100000747449 [0,1,0,0,1,0|1,1,0]=4 1088 B22R3.2209667 C=COC(=O)COc1cccc2c1c3c(o2)cccc3 34a_100010256132_100000036128 [0,1,0,0,1,0|1,0,1]=4 1089 B22R3.2209667 CCCC(=O)COc1cccc2c1c3c(o2)cccc3 7a_100010256132_100000747444 [0,1,0,0,1,0|2,0,0]=4 1090 B22R3.2209667 CCNC(=O)COc1cccc2c1c3c(o2)cccc3 34a_100010256132_100000183381 [0,1,0,0,1,0|2,0,0]=4 1091 B22R3.2209667 CCNC(=O)COc1cccc2c1c3c(o2)cccc3 7a_100010256132_100000183381 [0,1,0,0,1,0|2,0,0]=4 1092 B22R3.2209667 CCOC(=O)CNc1cccc2c1c3c(o2)cccc3 34a_100009830322_100000188475 [0,1,0,0,1,0|2,0,0]=4 1093 B22R3.2209667 CCOC(=O)COc1cccc2c1c3c(o2)cccc3 34a_100010256132_100000188475 [0,1,0,0,1,0|1,0,0]=3 1094 B22R3.2209667 CCOC(=O)COc1cccc2c1c3c(o2)cccc3 7a_100010256132_100000188475 [0,1,0,0,1,0|1,0,0]=3 1095 B22R3.2209667 O=C(COc1cccc2c1c3c(o2)cccc3)NCO 34a_100010256132_100000185155 [0,1,0,0,1,0|2,0,0]=4 1096 B22R3.2209667 O=C(COc1cccc2c1c3c(o2)cccc3)NCO 7a_100010256132_100000185155 [0,1,0,0,1,0|2,0,0]=4 1097 B22R3.2407566 CCC(=O)C(C)Oc1cccc2c1c3c(o2)cccc3 7a_100010256132_100000742827 [0,1,0,0,1,0|2,0,0]=4 1098 B22R3.2407566 CNC(=O)C(C)Oc1cccc2c1c3c(o2)cccc3 34a_100010256132_100000731044 [0,1,0,0,1,0|2,0,0]=4 1099 B22R3.2407566 CNC(=O)C(C)Oc1cccc2c1c3c(o2)cccc3 7a_100010256132_100000209862 [0,1,0,0,1,0|2,0,0]=4 1100 B22R3.2407566 CNC(=O)C(F)Oc1cccc2c1c3c(o2)cccc3 34a_100010256132_100009813575 [0,1,0,0,1,0|2,0,0]=4 1101 B22R3.2407566 CNC(=O)C(F)Oc1cccc2c1c3c(o2)cccc3 7a_100010256132_100009813575 [0,1,0,0,1,0|2,0,0]=4 1102 B22R3.2407566 COC(=O)C(C)Nc1cccc2c1c3c(o2)cccc3 34a_100009830322_100000211248 [0,1,0,0,1,0|2,0,0]=4 1103 B22R3.2407566 COC(=O)C(C)Oc1cccc2c1c3c(o2)cccc3 34a_100010256132_100000211248 [0,1,0,0,1,0|1,0,0]=3 1104 B22R3.2407566 COC(=O)C(C)Oc1cccc2c1c3c(o2)cccc3 7a_100010256132_100000211248 [0,1,0,0,1,0|1,0,0]=3 1105 B22R3.23385050 CC(=O)C(=O)COc1cccc2c1c3c(o2)cccc3 34a_100010256132_100011261029 [0,1,0,0,1,0|2,0,0]=4 1106 B22R3.23385050 CC(C)C(=O)COc1cccc2c1c3c(o2)cccc3 34a_100010256132_100000753385 [0,1,0,0,1,0|2,0,0]=4 1107 B22R3.23385050 CC(C)C(=O)COc1cccc2c1c3c(o2)cccc3 7a_100010256132_100000753385 [0,1,0,0,1,0|2,0,0]=4 1108 B22R3.23385050 CN(C)C(=O)COc1cccc2c1c3c(o2)cccc3 34a_100010256132_100000692301 [0,1,0,0,1,0|2,0,0]=4 1109 B22R3.23385050 CN(C)C(=O)COc1cccc2c1c3c(o2)cccc3 7a_100010256132_100000692301 [0,1,0,0,1,0|2,0,0]=4 1110 B24R3.1253654 CNC(=O)CCNc1cccc2c1nc3c(n2)cc(cc3)Cl 27a_100000738227_100160470743 [0,1,0,0,0,1|2,0,0]=4 1111 B24R3.3308431 C=C(CNc1cccc2c1nc3c(c2)cccc3)C(=O)OC 34a_200000072084_100009813391 [0,1,0,0,0,1|2,0,0]=4 1112 B24R3.3308431 C=C(COc1cccc2c1nc3c(n2)cccc3)C(=O)OC 34a_100000029702_100009813391 [0,1,0,0,0,1|0,0,0]=2 1113 B24R3.3308431 CNC(=O)C(C)CNc1cccc2c1nc3c(n2)cccc3 27a_100015187722_100010275551 [0,1,0,0,0,1|2,0,0]=4 1114 B24R3.3308431 COC(=O)C(=O)CNc1cccc2c1nc3c(c2)cccc3 34a_200000072084_100011610305 [0,1,0,0,0,1|2,0,0]=4 1115 B24R3.3308431 COC(=O)C(=O)COc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100011610305 [0,1,0,0,0,1|0,0,0]=2 1116 B24R3.3308431 COC(=O)C(C)CNc1cccc2c1nc3c(c2)cccc3 34a_200000072084_100000698445 [0,1,0,0,0,1|2,0,0]=4 1117 B24R3.3308431 COC(=O)C(C)COc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100000698445 [0,1,0,0,0,1|0,0,0]=2 1118 B24R3.23161923 CCS(=O)(=O)CCOc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100000756660 [0,1,0,0,0,1|2,0,0]=4 1119 B24R3.28010305 COC(CCOc1cccc2c1nc3c(n2)cccc3)OC 34a_100000029702_100000139399 [0,1,0,0,0,1|0,0,2]=4 1120 B24R3.31653459 COC(=O)CC(=O)Nc1cccc2c1nc3c(c2)cccc3 22a_200000072084_100000211351 [0,1,0,0,0,1|2,0,0]=4 1121 B24R3.31653459 COC(=O)CC(C)Nc1cccc2c1nc3c(c2)cccc3 34a_200000072084_100009817358 [0,1,0,0,0,1|2,0,0]=4 1122 B24R3.31653459 COC(=O)CC(C)Oc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100009817358 [0,1,0,0,0,1|0,0,0]=2 1123 B24R3.32454460 CCCC(=O)OCOc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100000034017 [0,1,0,0,0,1|1,0,0]=3 1124 B24R3.32454460 CCNC(=O)CCNc1cccc2c1nc3c(n2)cccc3 27a_100025743525_100010275551 [0,1,0,0,0,1|2,0,0]=4 1125 B24R3.32454460 CCOC(=O)CCNc1cccc2c1nc3c(c2)cccc3 34a_200000072084_100000765890 [0,1,0,0,0,1|2,0,0]=4 1126 B24R3.32454460 CCOC(=O)CCOc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100000765890 [0,1,0,0,0,1|0,0,0]=2 1127 B24R3.40446340 CNC(=O)CCNc1cccc2c1nc3c(n2)ccc(c3)Cl 27a_100000738227_100160470744 [0,1,0,0,0,1|2,0,0]=4 1128 B24R3.123699047 CNC(=O)CCN(C)c1cccc2c1nc3c(n2)cccc3 27a_100000750875_100010275551 [0,1,0,0,0,1|2,0,0]=4 1129 B24R3.123699047 CNC(=O)CNC(=O)c1cccc2c1nc3c(n2)cccc3 11a_100000693194_200016989829 [0,1,0,0,0,1|2,0,0]=4 1130 B24R3.123699047 CNC(=O)CNC(=O)c1cccc2c1nc3c(n2)cccc3 240690a_100000693194_200016989829 [0,1,0,0,0,1|2,0,0]=4 1131 B24R3.123699047 COC(=O)CNC(=O)c1cccc2c1nc3c(c2)cccc3 188690a_100000185156_100020631721 [0,1,0,0,0,1|2,0,0]=4 1132 B24R3.123699047 COC(=O)CNC(=O)c1cccc2c1nc3c(n2)cccc3 188690a_100000185156_200016989829 [0,1,0,0,0,1|1,0,0]=3 1133 B24R3.248746388 CN(C)C(=O)CCNc1cccc2c1nc3c(n2)cccc3 27a_100000738053_100010275551 [0,1,0,0,0,1|2,0,0]=4 1134 B24R3.335107573 CNC(=O)CCNc1cccc2c1nc3c(n2)cccc3Cl 27a_100000738227_100160470748 [0,1,0,0,0,1|2,0,0]=4 1135 B24R3.657546 CNC(=O)CN(C)c1cccc2c1nc3c(n2)cc(cc3)Cl 27a_100000189611_100160470743 [0,2,0,0,0,0|2,0,0]=4 1136 B24R3.657546 COC(=O)CN(C)c1cccc2c1nc3c(n2)cc(cc3)Cl 27a_100000198492_100160470743 [0,2,0,0,0,0|1,0,0]=3 1137 B24R3.1866211 CCNC(=O)CNc1cccc2c1nc3c(n2)cc(cc3)Cl 27a_100016988866_100160470743 [0,2,0,0,0,0|2,0,0]=4 1138 B24R3.1866211 CCOC(=O)C=Cc1cccc2c1nc3c(n2)cc(cc3)Cl 271570a_100010199719_100160470743 [0,2,0,0,0,0|1,0,1]=4 1139 B24R3.1911594 CNC(=O)[C@@H](C)Nc1cccc2c1nc3c(n2)cc(cc3)Cl 27a_100000684985_100160470743 [0,2,0,0,0,0|2,0,0]=4 1140 B24R3.1590877433 CN(C)C(=O)CCc1cccc2c1nc3c(n2)cc(cc3)Cl 271570a_200010232142_100160470743 [0,2,0,0,0,0|2,0,0]=4 1141 B24R3.1590877433 CN(C)C(=O)CNc1cccc2c1nc3c(n2)cc(cc3)Cl 27a_100015183351_100160470743 [0,2,0,0,0,0|2,0,0]=4 1142 B24R3.38189392 COC(=O)COc1cccc2c1C(=O)c3ccccc3C2=O 7a_100000069534_100000747449 [0,2,0,0,0,0|2,0,0]=4 1143 B24R3.49980629 C#CCNC(=O)CNc1cccc2c1nc3c(n2)cccc3 27a_100000747989_100010275551 [0,2,0,0,0,0|2,0,0]=4 1144 B24R3.49980629 C=C(COc1cccc2c1nc3c(n2)cccc3)OCOC 34a_100000029702_100000042856 [0,2,0,0,0,0|1,0,0]=3 1145 B24R3.49980629 C=CCOC(=O)CNc1cccc2c1nc3c(c2)cccc3 34a_200000072084_100000033060 [0,2,0,0,0,0|2,0,0]=4 1146 B24R3.49980629 C=CCOC(=O)COc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100000033060 [0,2,0,0,0,0|0,0,0]=2 1147 B24R3.49980629 CCCNC(=O)CNc1cccc2c1nc3c(n2)cccc3 27a_100000174927_100010275551 [0,2,0,0,0,0|2,0,0]=4 1148 B24R3.49980629 CCCNC(=O)COc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100000183358 [0,2,0,0,0,0|1,0,0]=3 1149 B24R3.49980629 CCCOC(=O)CNc1cccc2c1nc3c(c2)cccc3 34a_200000072084_200011215008 [0,2,0,0,0,0|2,0,0]=4 1150 B24R3.49980629 CCCOC(=O)COc1cccc2c1nc3c(n2)cccc3 34a_100000029702_200011215008 [0,2,0,0,0,0|0,0,0]=2 1151 B24R3.49980629 O=C(CNc1cccc2c1nc3c(n2)cccc3)NCCF 27a_100000725713_100010275551 [0,2,0,0,0,0|2,0,0]=4 1152 B24R3.50500533 CCNC(=O)CNc1cccc2c1nc3c(n2)ccc(c3)Cl 27a_100016988866_100160470744 [0,2,0,0,0,0|2,0,0]=4 1153 B24R3.50500533 CCOC(=O)C=Cc1cccc2c1nc3c(n2)ccc(c3)Cl 271570a_100010199719_100160470744 [0,2,0,0,0,0|1,0,1]=4 1154 B24R3.60025018 C=COC(=O)CC(=O)c1cccc2c1nc3c(n2)cccc3 1458a_200016989829_100000036128 [0,2,0,0,0,0|1,0,1]=4 1155 B24R3.60025018 CCCC(=O)CC(=O)c1cccc2c1nc3c(n2)cccc3 1458a_200016989829_100000747444 [0,2,0,0,0,0|2,0,0]=4 1156 B24R3.60025018 CCNC(=O)CC(=O)c1cccc2c1nc3c(n2)cccc3 1458a_200016989829_100000183381 [0,2,0,0,0,0|2,0,0]=4 1157 B24R3.60025018 CCNC(=O)CN(C)c1cccc2c1nc3c(n2)cccc3 27a_100000741943_100010275551 [0,2,0,0,0,0|2,0,0]=4 1158 B24R3.60025018 CCOC(=O)/C=C(\C)/c1cccc2c1nc3c(n2)cccc3 271570a_100050291487_100010275551 [0,2,0,0,0,0|1,0,1]=4 1159 B24R3.60025018 CCOC(=O)CC(=O)c1cccc2c1nc3c(c2)cccc3 1458a_100020631721_100000188475 [0,2,0,0,0,0|2,0,0]=4 1160 B24R3.60025018 CCOC(=O)CC(=O)c1cccc2c1nc3c(n2)cccc3 1458a_200016989829_100000188475 [0,2,0,0,0,0|1,0,0]=3 1161 B24R3.60025018 CCOC(=O)CN(C)c1cccc2c1nc3c(n2)cccc3 27a_100000220588_100010275551 [0,2,0,0,0,0|1,0,0]=3 1162 B24R3.60025018 O=C(CC(=O)c1cccc2c1nc3c(n2)cccc3)NCO 1458a_200016989829_100000185155 [0,2,0,0,0,0|2,0,0]=4 1163 B24R3.65733009 CCNC(=O)C(C)Nc1cccc2c1nc3c(n2)cccc3 27a_100000736553_100010275551 [0,2,0,0,0,0|2,0,0]=4 1164 B24R3.65733009 CCNC(=O)C(C)Oc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100000230173 [0,2,0,0,0,0|1,0,0]=3 1165 B24R3.65733009 CCOC(=O)C(=O)Nc1cccc2c1nc3c(n2)cccc3 11a_100000029703_100014798877 [0,2,0,0,0,0|1,0,1]=4 1166 B24R3.65733009 CCOC(=O)C(=O)Nc1cccc2c1nc3c(n2)cccc3 1626a_100000029703_100014798877 [0,2,0,0,0,0|1,0,1]=4 1167 B24R3.65733009 CCOC(=O)C(C)Nc1cccc2c1nc3c(c2)cccc3 34a_200000072084_100011216346 [0,2,0,0,0,0|2,0,0]=4 1168 B24R3.65733009 CCOC(=O)C(C)Oc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100011216346 [0,2,0,0,0,0|0,0,0]=2 1169 B24R3.65733009 CCOC(=O)C(F)Nc1cccc2c1nc3c(c2)cccc3 34a_200000072084_100000760018 [0,2,0,0,0,0|2,0,0]=4 1170 B24R3.65733009 CCOC(=O)C(F)Oc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100000760018 [0,2,0,0,0,0|0,0,0]=2 1171 B24R3.65733009 CCSC(=O)[C@H](C)Nc1cccc2c1nc3c(n2)cccc3 27a_100103168634_100010275551 [0,2,0,0,0,0|1,1,0]=4 1172 B24R3.247437159 CC(C)NC(=O)CNc1cccc2c1nc3c(n2)cccc3 27a_100000168517_100010275551 [0,2,0,0,0,0|2,0,0]=4 1173 B24R3.247437159 CC(C)NC(=O)COc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100000183996 [0,2,0,0,0,0|1,0,0]=3 1174 B24R3.247437159 CC(C)OC(=O)CNc1cccc2c1nc3c(c2)cccc3 34a_200000072084_100011215430 [0,2,0,0,0,0|2,0,0]=4 1175 B24R3.247437159 CC(C)OC(=O)COc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100011215430 [0,2,0,0,0,0|0,0,0]=2 1176 B24R3.411391858 CCNC(=O)CNc1cccc2c1nc3c(n2)cccc3Cl 27a_100016988866_100160470748 [0,2,0,0,0,0|2,0,0]=4 1177 B24R3.411391858 CCOC(=O)C=Cc1cccc2c1nc3c(n2)cccc3Cl 271570a_100010199719_100160470748 [0,2,0,0,0,0|1,0,1]=4 1178 B24R3.51211364 CNC(=O)[C@@H](C)Nc1cccc2c1nc3c(n2)ccc(c3)Cl 27a_100000684985_100160470744 [0,2,0,0,0,0|2,0,0]=4 1179 B24R3.76614644 CCC(=O)C(C)C(=O)c1cccc2c1nc3c(n2)cccc3 1458a_200016989829_100000742827 [0,2,0,0,0,0|2,0,0]=4 1180 B24R3.76614644 CNC(=O)C(C)C(=O)c1cccc2c1nc3c(n2)cccc3 1458a_200016989829_100000209862 [0,2,0,0,0,0|2,0,0]=4 1181 B24R3.76614644 CNC(=O)C(F)C(=O)c1cccc2c1nc3c(n2)cccc3 1458a_200016989829_100009813575 [0,2,0,0,0,0|2,0,0]=4 1182 B24R3.76614644 COC(=O)C(C)C(=O)c1cccc2c1nc3c(c2)cccc3 1458a_100020631721_100000211248 [0,2,0,0,0,0|2,0,0]=4 1183 B24R3.76614644 COC(=O)C(C)C(=O)c1cccc2c1nc3c(n2)cccc3 1458a_200016989829_100000211248 [0,2,0,0,0,0|1,0,0]=3 1184 B24R3.76614644 COC(=O)C(C)N(C)c1cccc2c1nc3c(n2)cccc3 27a_100000725243_100010275551 [0,2,0,0,0,0|1,0,0]=3 1185 B24R3.77970913 COC(OC)C(C)Oc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100011222894 [0,2,0,0,0,0|0,0,2]=4 1186 B24R3.120109587 C[C@H](Nc1cccc2c1nc3c(n2)cccc3)C(=O)N(C)C 27a_100000697320_100010275551 [0,2,0,0,0,0|2,0,0]=4 1187 B24R3.208344399 COC(F)(F)C(F)Oc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100000036909 [0,2,0,0,0,0|1,0,1]=4 1188 B24R3.317032907 CCC(Nc1cccc2c1nc3c(c2)cccc3)C(=O)OC 34a_200000072084_100000235869 [0,2,0,0,0,0|2,0,0]=4 1189 B24R3.317032907 CCC(Oc1cccc2c1nc3c(n2)cccc3)C(=O)OC 34a_100000029702_100000235869 [0,2,0,0,0,0|0,0,0]=2 1190 B24R3.317032907 CC[C@H](Nc1cccc2c1nc3c(n2)cccc3)C(=O)NC 27a_106657271573_100010275551 [0,2,0,0,0,0|2,0,0]=4 1191 B24R3.317032907 COC(=O)C(C=O)Nc1cccc2c1nc3c(c2)cccc3 34a_200000072084_100000046368 [0,2,0,0,0,0|2,0,0]=4 1192 B24R3.317032907 COC(=O)C(C=O)Oc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100000046368 [0,2,0,0,0,0|0,0,0]=2 1193 B24R3.317032907 COC(=O)C(CO)Nc1cccc2c1nc3c(c2)cccc3 34a_200000072084_100012276630 [0,2,0,0,0,0|2,0,0]=4 1194 B24R3.317032907 COC(=O)C(CO)Oc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100012276630 [0,2,0,0,0,0|0,0,0]=2 1195 B24R3.317032907 COC(=O)C(Nc1cccc2c1nc3c(c2)cccc3)OC 34a_200000072084_100000101307 [0,2,0,0,0,0|2,0,0]=4 1196 B24R3.317032907 COC(=O)C(OC)Oc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100000101307 [0,2,0,0,0,0|0,0,0]=2 1197 B24R3.417011344 CNC(=O)[C@@H](C)Nc1cccc2c1nc3c(n2)cccc3Cl 27a_100000684985_100160470748 [0,2,0,0,0,0|2,0,0]=4 1198 B24R3.421285315 CNC(=O)C(C)(C)Oc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100000732697 [0,2,0,0,0,0|1,0,0]=3 1199 B24R3.421285315 COC(=O)C(C)(F)Nc1cccc2c1nc3c(c2)cccc3 34a_200000072084_200009867631 [0,2,0,0,0,0|2,0,0]=4 1200 B24R3.421285315 COC(=O)C(C)(F)Oc1cccc2c1nc3c(n2)cccc3 34a_100000029702_200009867631 [0,2,0,0,0,0|0,0,0]=2 1201 B24R3.421285315 COC(=O)C(F)(F)Nc1cccc2c1nc3c(c2)cccc3 34a_200000072084_100000211177 [0,2,0,0,0,0|2,0,0]=4 1202 B24R3.421285315 COC(=O)C(F)(F)Oc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100000211177 [0,2,0,0,0,0|0,0,0]=2 1203 B24R3.421805448 COC(C)(COc1cccc2c1nc3c(n2)cccc3)OC 34a_100000029702_100000766008 [0,2,0,0,0,0|0,0,2]=4 1204 B24R3.31763985 CNC(=O)CN(C)c1cccc2c1nc3c(n2)ccc(c3)Cl 27a_100000189611_100160470744 [0,2,0,0,0,0|2,0,0]=4 1205 B24R3.31763985 COC(=O)CN(C)c1cccc2c1nc3c(n2)ccc(c3)Cl 27a_100000198492_100160470744 [0,2,0,0,0,0|1,0,0]=3 1206 B24R3.246448662 CC(=O)C(=O)CC(=O)c1cccc2c1nc3c(n2)cccc3 1458a_200016989829_100011261029 [0,2,0,0,0,0|2,0,0]=4 1207 B24R3.246448662 CC(C)C(=O)CC(=O)c1cccc2c1nc3c(n2)cccc3 1458a_200016989829_100000753385 [0,2,0,0,0,0|2,0,0]=4 1208 B24R3.246448662 CN(C)C(=O)CC(=O)c1cccc2c1nc3c(n2)cccc3 1458a_200016989829_100000185267 [0,2,0,0,0,0|2,0,0]=4 1209 B24R3.246448662 CN(C)C(=O)CN(C)c1cccc2c1nc3c(n2)cccc3 27a_100000185065_100010275551 [0,2,0,0,0,0|2,0,0]=4 1210 B24R3.271932154 CNC(=O)CN(C)c1cccc2c1nc3c(n2)cccc3Cl 27a_100000189611_100160470748 [0,2,0,0,0,0|2,0,0]=4 1211 B24R3.271932154 COC(=O)CN(C)c1cccc2c1nc3c(n2)cccc3Cl 27a_100000198492_100160470748 [0,2,0,0,0,0|1,0,0]=3 1212 B24R3.118822297 CN(C)C(=O)CCc1cccc2c1nc3c(n2)ccc(c3)Cl 271570a_200010232142_100160470744 [0,2,0,0,0,0|2,0,0]=4 1213 B24R3.118822297 CN(C)C(=O)CNc1cccc2c1nc3c(n2)ccc(c3)Cl 27a_100015183351_100160470744 [0,2,0,0,0,0|2,0,0]=4 1214 B24R3.28934376 CC(C)(C)C(=O)COc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100000229897 [0,2,0,0,0,0|1,0,0]=3 1215 B24R3.28934376 O=C(COc1cccc2c1nc3c(n2)cccc3)C(F)(F)F 34a_100000029702_100000002480 [0,2,0,0,0,0|2,0,0]=4 1216 B24R3.215992489 CN(C)C(=O)CCc1cccc2c1nc3c(n2)cccc3Cl 271570a_200010232142_100160470748 [0,2,0,0,0,0|2,0,0]=4 1217 B24R3.215992489 CN(C)C(=O)CNc1cccc2c1nc3c(n2)cccc3Cl 27a_100015183351_100160470748 [0,2,0,0,0,0|2,0,0]=4 1218 B22R3.1041599 COC(=O)COc1ccc2cc3ccccc3cc2c1 34a_100000083918_100000747449 [0,0,1,1,0,0|2,0,0]=4 1219 B22R3.1041599 COC(=O)COc1ccc2cc3ccccc3cc2c1 7a_100000083918_100000747449 [0,0,1,1,0,0|2,0,0]=4 1220 B22R3.15512197 COC(=O)COc1cccc2c1c3c(cc2)cccc3 34a_200000075460_100000747449 [0,0,1,1,0,0|2,0,0]=4 1221 B22R3.15512197 COC(=O)COc1cccc2c1c3c(cc2)cccc3 7a_200000075460_100000747449 [0,0,1,1,0,0|2,0,0]=4 1222 B22R3.1038281 COC(=O)c1ccccc1c2cnc3ccccc3n2 271570a_100000034818_100000756483 [0,0,1,1,0,0|1,0,1]=4 1223 B22R3.1055358 COC(=O)c1occc1Sc2cnc3ccccc3n2 62a_100000756483_100012676306 [0,0,1,1,0,0|1,0,1]=4 1224 B22R3.47955 COC(=O)c1ccc(o1)c2nc3ccccc3nc2C 271570a_200009885950_100000185947 [0,0,1,1,0,0|0,0,2]=4 1225 B22R3.47955 COC(=O)c1ccc(o1)c2nc3ccccc3nc2N 271570a_200009885950_100000009970 [0,0,1,1,0,0|1,0,1]=4 1226 B22R3.48211 COC(=O)c1cccc(c1)c2cnc3ccccc3n2 271570a_100009828367_100000756483 [0,0,1,1,0,0|1,0,1]=4 1227 B22R4.3151477 C1=CCN(C1)c2cccc3c2nc4c(n3)cccc4 27a_100015195280_100010275551 [1,0,0,1,0,0|2,0,0]=4 1228 B22R4.937958135 c1ccc2nc3c(cccc3nc2c1)OCC4CC4 34a_100000029702_100000742324 [1,0,0,1,0,0|1,0,1]=4 1229 B22R4.937958135 c1ccc2nc3c(cccc3nc2c1)OCC4CO4 34a_100000029702_102125554688 [1,0,0,1,0,0|0,0,1]=3 1230 B22R4.937958136 c1ccc2nc3c(cccc3nc2c1)NC4COC4 27a_100016991112_100010275551 [1,0,0,1,0,0|1,0,1]=4 1231 B22R4.937958136 c1ccc2nc3c(cccc3nc2c1)OC4CCC4 34a_100000029702_100000749161 [1,0,0,1,0,0|1,0,1]=4 1232 B22R4.937958136 c1ccc2nc3c(cccc3nc2c1)OC4COC4 34a_100000029702_100009818527 [1,0,0,1,0,0|0,0,1]=3 1233 B22R4.34867 O=C1CCC1Oc2cccc3c2oc4c3cccc4 34a_100010256078_100009892977 [0,0,0,1,1,0|2,0,0]=4 1234 B22R4.34867 O=C1CCC1Oc2cccc3c2oc4c3cccc4 7a_100010256078_100009892977 [0,0,0,1,1,0|2,0,0]=4 1235 B22R4.34898 O=C1CCC1Oc2cccc3c2c4c(o3)cccc4 34a_100010256132_100009892977 [0,0,0,1,1,0|2,0,0]=4 1236 B22R4.34898 O=C1CCC1Oc2cccc3c2c4c(o3)cccc4 7a_100010256132_100009892977 [0,0,0,1,1,0|2,0,0]=4 1237 B24R4.2012847 O=C1CC(CN1)Nc2cccc3c2nc4c(n3)cccc4 27a_100000697751_100010275551 [0,0,0,1,0,1|2,0,0]=4 1238 B24R4.2012847 O=C1OCC(O1)Nc2cccc3c2nc4c(c3)cccc4 34a_200000072084_100000032252 [0,0,0,1,0,1|2,0,0]=4 1239 B24R4.2012847 O=C1OCC(O1)Oc2cccc3c2nc4c(n3)cccc4 34a_100000029702_100000032252 [0,0,0,1,0,1|0,0,0]=2 1240 B24R4.50114319 COC(=O)C1CN1c2cccc3c2nc4c(n3)cccc4 27a_200009830135_100010275551 [0,0,0,1,0,1|1,0,0]=3 1241 B24R4.2009363 O=C1CN(CN1)c2cccc3c2nc4c(n3)cc(cc4)Cl 27a_200000708111_100160470743 [0,1,0,1,0,0|2,0,0]=4 1242 B24R4.2338234 O=C1CCCC1Oc2cccc3c2nc4c(n3)cccc4 34a_100000029702_100000709159 [0,1,0,1,0,0|1,0,0]=3 1243 B24R4.2338234 O=C1NCCC1Nc2cccc3c2nc4c(n3)cccc4 27a_100016995588_100010275551 [0,1,0,1,0,0|2,0,0]=4 1244 B24R4.2338234 O=C1OCCC1Nc2cccc3c2nc4c(c3)cccc4 34a_200000072084_100000211211 [0,1,0,1,0,0|2,0,0]=4 1245 B24R4.2338234 O=C1OCCC1Oc2cccc3c2nc4c(n3)cccc4 34a_100000029702_100000211211 [0,1,0,1,0,0|0,0,0]=2 1246 B24R4.2338234 OC1COCC1Oc2cccc3c2nc4c(n3)cccc4 34a_100000029702_200000725654 [0,1,0,1,0,0|0,0,2]=4 1247 B24R4.6565729 c1ccc2nc3c(cccc3nc2c1)OCC4=NCCN4 34a_100000029702_100000737910 [0,1,0,1,0,0|2,0,0]=4 1248 B24R4.6565729 c1ccc2nc3c(cccc3nc2c1)OCC4CCOC4 34a_100000029702_100011261433 [0,1,0,1,0,0|1,0,1]=4 1249 B24R4.6565729 c1ccc2nc3c(cccc3nc2c1)OCC4OCCO4 34a_100000029702_100000755774 [0,1,0,1,0,0|0,0,2]=4 1250 B24R4.6565729 c1ccc2nc3c(cccc3nc2c1)OCc4ccon4 34a_100000029702_100000234950 [0,1,0,1,0,0|1,0,1]=4 1251 B24R4.6565729 c1ccc2nc3c(cccc3nc2c1)OCc4ncco4 34a_100000029702_103436540062 [0,1,0,1,0,0|1,0,1]=4 1252 B24R4.6565729 c1ccc2nc3c(cccc3nc2c1)OCc4ncon4 34a_100000029702_100000233494 [0,1,0,1,0,0|1,0,1]=4 1253 B24R4.13957569 O=C1CN(CCN1)c2cccc3c2nc4c(n3)cccc4 27a_100000184651_100010275551 [0,1,0,1,0,0|2,0,0]=4 1254 B24R4.42076946 O=C(COc1cccc2c1nc3c(n2)cccc3)C4CC4 34a_100000029702_100000746382 [0,1,0,1,0,0|1,0,0]=3 1255 B24R4.178443649 CC1(COC1)COc2cccc3c2nc4c(n3)cccc4 34a_100000029702_100009817586 [0,1,0,1,0,0|1,0,1]=4 1256 B24R4.100604763 CCC1(CO1)COc2cccc3c2nc4c(n3)cccc4 34a_100000029702_200000139556 [0,1,0,1,0,0|1,0,1]=4 1257 B24R4.16305205 O=C1CCC1C(=O)c2cccc3c2nc4c(n3)cccc4 1458a_200016989829_100009892977 [0,1,0,1,0,0|2,0,0]=4 1258 B24R4.142351176 O=C1CN(CN1)c2cccc3c2nc4c(n3)ccc(c4)Cl 27a_200000708111_100160470744 [0,1,0,1,0,0|2,0,0]=4 1259 B24R4.142351170 O=C1CN(CN1)c2cccc3c2nc4c(n3)cccc4Cl 27a_200000708111_100160470748 [0,1,0,1,0,0|2,0,0]=4 1260 B20R2.351 COC(=O)CSc1cccc(c1O)c2ccccc2 62a_200034179028_100000747449 [0,0,1,0,1,0|1,1,0]=4 1261 B20R2.2811 COC(=O)Cc1cccc(c1F)Sc2ccccc2 62a_100000719477_100010741560 [0,0,1,0,1,0|2,0,0]=4 1262 B20R2.2811 COC(=O)Cc1cccc(c1F)Sc2ccccc2 62a_100010741560_100000041952 [0,0,1,0,1,0|2,0,0]=4 1263 B20R2.2811 COC(=O)Cc1cccc(c1O)Sc2ccccc2 62a_100010150830_100000041952 [0,0,1,0,1,0|2,0,0]=4 1264 B20R2.18013 CCC(=O)COc1cccc(c1)c2ccccc2C 7a_100011997977_100000747405 [0,0,1,0,1,0|2,0,0]=4 1265 B20R2.18013 CNC(=O)COc1cccc(c1)c2ccccc2C 271570a_100000747142_200000150594 [0,0,1,0,1,0|2,0,0]=4 1266 B20R2.18013 CNC(=O)COc1cccc(c1)c2ccccc2C 34a_100011997977_100000183359 [0,0,1,0,1,0|2,0,0]=4 1267 B20R2.18013 CNC(=O)COc1cccc(c1)c2ccccc2C 7a_100011997977_100000183359 [0,0,1,0,1,0|2,0,0]=4 1268 B20R2.18013 CNC(=O)COc1cccc(c1)c2ccccc2Cl 271570a_100011934419_200000150594 [0,0,1,0,1,0|2,0,0]=4 1269 B20R2.18013 CNC(=O)COc1cccc(c1)c2ccccc2F 271570a_100000761933_200000150594 [0,0,1,0,1,0|2,0,0]=4 1270 B20R2.18013 CNC(=O)COc1cccc(c1)c2ccccc2I 271570a_100000069755_200000150594 [0,0,1,0,1,0|2,0,0]=4 1271 B20R2.18013 CNC(=O)COc1cccc(c1)c2ccccc2N 271570a_100000034411_200000150594 [0,0,1,0,1,0|1,0,1]=4 1272 B20R2.18013 CNC(=O)COc1cccc(c1)c2ccccc2O 271570a_100000035170_200000150594 [0,0,1,0,1,0|2,0,0]=4 1273 B20R2.18013 COC(=O)CCc1cccc(c1)c2ccccc2Br 271570a_100010083044_100000695589 [0,0,1,0,1,0|2,0,0]=4 1274 B20R2.18013 COC(=O)CCc1cccc(c1)c2ccccc2C 271570a_100000747142_100000151591 [0,0,1,0,1,0|2,0,0]=4 1275 B20R2.18013 COC(=O)CCc1cccc(c1)c2ccccc2C 271570a_100010083044_100000210755 [0,0,1,0,1,0|2,0,0]=4 1276 B20R2.18013 COC(=O)CCc1cccc(c1)c2ccccc2Cl 271570a_100010083044_100000764095 [0,0,1,0,1,0|2,0,0]=4 1277 B20R2.18013 COC(=O)CCc1cccc(c1)c2ccccc2Cl 271570a_100011934419_100000151591 [0,0,1,0,1,0|2,0,0]=4 1278 B20R2.18013 COC(=O)CCc1cccc(c1)c2ccccc2F 271570a_100000761933_100000151591 [0,0,1,0,1,0|2,0,0]=4 1279 B20R2.18013 COC(=O)CCc1cccc(c1)c2ccccc2F 271570a_100010083044_100011215700 [0,0,1,0,1,0|2,0,0]=4 1280 B20R2.18013 COC(=O)CCc1cccc(c1)c2ccccc2I 271570a_100000069755_100000151591 [0,0,1,0,1,0|2,0,0]=4 1281 B20R2.18013 COC(=O)CCc1cccc(c1)c2ccccc2N 271570a_100000034411_100000151591 [0,0,1,0,1,0|1,0,1]=4 1282 B20R2.18013 COC(=O)CCc1cccc(c1)c2ccccc2N 271570a_100010083044_100000210017 [0,0,1,0,1,0|1,0,1]=4 1283 B20R2.18013 COC(=O)CCc1cccc(c1)c2ccccc2O 271570a_100000035170_100000151591 [0,0,1,0,1,0|2,0,0]=4 1284 B20R2.18013 COC(=O)CCc1cccc(c1)c2ccccc2O 271570a_100010083044_100000739446 [0,0,1,0,1,0|2,0,0]=4 1285 B20R2.18013 COC(=O)CNc1cccc(c1)c2ccccc2C 34a_200015183441_100000747449 [0,0,1,0,1,0|2,0,0]=4 1286 B20R2.18013 COC(=O)CNc1cccc(c1)c2ccccc2C 7a_200015183441_100000747449 [0,0,1,0,1,0|2,0,0]=4 1287 B20R2.18013 COC(=O)COc1cccc(c1)c2c[nH]ccc2=O 271570a_100010253087_100009998708 [0,0,1,0,1,0|2,0,0]=4 1288 B20R2.18013 COC(=O)COc1cccc(c1)c2c[nH]ccc2=S 271570a_100010253087_200012280681 [0,0,1,0,1,0|2,0,0]=4 1289 B20R2.18013 COC(=O)COc1cccc(c1)c2ccc[nH]c2=O 271570a_100000099769_200000148702 [0,0,1,0,1,0|2,0,0]=4 1290 B20R2.18013 COC(=O)COc1cccc(c1)c2ccc[nH]c2=O 271570a_100010253087_100000050042 [0,0,1,0,1,0|2,0,0]=4 1291 B20R2.18013 COC(=O)COc1cccc(c1)c2cccc[n+]2C 271570a_100010253087_100000212160 [0,0,1,0,1,0|2,0,0]=4 1292 B20R2.18013 COC(=O)COc1cccc(c1)c2cccc[n+]2[O-] 271570a_100010253087_200000042595 [0,0,1,0,1,0|2,0,0]=4 1293 B20R2.18013 COC(=O)COc1cccc(c1)c2ccccc2Br 271570a_100010253087_100000695589 [0,0,1,0,1,0|1,0,0]=3 1294 B20R2.18013 COC(=O)COc1cccc(c1)c2ccccc2C 271570a_100000747142_200000148702 [0,0,1,0,1,0|1,0,0]=3 1295 B20R2.18013 COC(=O)COc1cccc(c1)c2ccccc2C 271570a_100010253087_100000210755 [0,0,1,0,1,0|1,0,0]=3 1296 B20R2.18013 COC(=O)COc1cccc(c1)c2ccccc2C 34a_100011997977_100000747449 [0,0,1,0,1,0|1,0,0]=3 1297 B20R2.18013 COC(=O)COc1cccc(c1)c2ccccc2C 7a_100011997977_100000747449 [0,0,1,0,1,0|1,0,0]=3 1298 B20R2.18013 COC(=O)COc1cccc(c1)c2ccccc2Cl 271570a_100010253087_100000764095 [0,0,1,0,1,0|1,0,0]=3 1299 B20R2.18013 COC(=O)COc1cccc(c1)c2ccccc2Cl 271570a_100011934419_200000148702 [0,0,1,0,1,0|1,0,0]=3 1300 B20R2.18013 COC(=O)COc1cccc(c1)c2ccccc2F 271570a_100000761933_200000148702 [0,0,1,0,1,0|1,0,0]=3 1301 B20R2.18013 COC(=O)COc1cccc(c1)c2ccccc2F 271570a_100010253087_100011215700 [0,0,1,0,1,0|1,0,0]=3 1302 B20R2.18013 COC(=O)COc1cccc(c1)c2ccccc2I 271570a_100000069755_200000148702 [0,0,1,0,1,0|1,0,0]=3 1303 B20R2.18013 COC(=O)COc1cccc(c1)c2ccccc2N 271570a_100000034411_200000148702 [0,0,1,0,1,0|0,0,1]=3 1304 B20R2.18013 COC(=O)COc1cccc(c1)c2ccccc2N 271570a_100010253087_100000210017 [0,0,1,0,1,0|0,0,1]=3 1305 B20R2.18013 COC(=O)COc1cccc(c1)c2ccccc2O 271570a_100000035170_200000148702 [0,0,1,0,1,0|1,0,0]=3 1306 B20R2.18013 COC(=O)COc1cccc(c1)c2ccccc2O 271570a_100010253087_100000739446 [0,0,1,0,1,0|1,0,0]=3 1307 B20R2.18013 COC(=O)COc1cccc(c1)c2cccnc2Br 271570a_100010253087_100010202626 [0,0,1,0,1,0|2,0,0]=4 1308 B20R2.18013 COC(=O)COc1cccc(c1)c2cccnc2C 271570a_100010253087_100000751574 [0,0,1,0,1,0|2,0,0]=4 1309 B20R2.18013 COC(=O)COc1cccc(c1)c2cccnc2C 271570a_100011934933_200000148702 [0,0,1,0,1,0|2,0,0]=4 1310 B20R2.18013 COC(=O)COc1cccc(c1)c2cccnc2Cl 271570a_100000047009_200000148702 [0,0,1,0,1,0|2,0,0]=4 1311 B20R2.18013 COC(=O)COc1cccc(c1)c2cccnc2Cl 271570a_100010253087_100000036424 [0,0,1,0,1,0|2,0,0]=4 1312 B20R2.18013 COC(=O)COc1cccc(c1)c2cccnc2F 271570a_100000042387_200000148702 [0,0,1,0,1,0|2,0,0]=4 1313 B20R2.18013 COC(=O)COc1cccc(c1)c2cccnc2F 271570a_100010253087_100009816115 [0,0,1,0,1,0|2,0,0]=4 1314 B20R2.18013 COC(=O)COc1cccc(c1)c2cccnc2N 271570a_100000071976_200000148702 [0,0,1,0,1,0|1,0,1]=4 1315 B20R2.18013 COC(=O)COc1cccc(c1)c2cccnc2N 271570a_100010253087_100000045569 [0,0,1,0,1,0|1,0,1]=4 1316 B20R2.18013 COC(=O)COc1cccc(c1)c2ccncc2Br 271570a_100010253087_100000726257 [0,0,1,0,1,0|2,0,0]=4 1317 B20R2.18013 COC(=O)COc1cccc(c1)c2ccncc2C 271570a_100000701363_200000148702 [0,0,1,0,1,0|2,0,0]=4 1318 B20R2.18013 COC(=O)COc1cccc(c1)c2ccncc2C 271570a_100010253087_100015191297 [0,0,1,0,1,0|2,0,0]=4 1319 B20R2.18013 COC(=O)COc1cccc(c1)c2ccncc2Cl 271570a_100000062318_200000148702 [0,0,1,0,1,0|2,0,0]=4 1320 B20R2.18013 COC(=O)COc1cccc(c1)c2ccncc2Cl 271570a_100010253087_100000708259 [0,0,1,0,1,0|2,0,0]=4 1321 B20R2.18013 COC(=O)COc1cccc(c1)c2ccncc2F 271570a_100010253087_100000047030 [0,0,1,0,1,0|2,0,0]=4 1322 B20R2.18013 COC(=O)COc1cccc(c1)c2ccncc2F 271570a_100011290801_200000148702 [0,0,1,0,1,0|2,0,0]=4 1323 B20R2.18013 COC(=O)COc1cccc(c1)c2ccncc2N 271570a_100010253087_100009815883 [0,0,1,0,1,0|1,0,1]=4 1324 B20R2.18013 COC(=O)COc1cccc(c1)c2ccncc2O 271570a_100010253087_100009817591 [0,0,1,0,1,0|2,0,0]=4 1325 B20R2.18013 COC(=O)COc1cccc(c1)c2cnccc2Br 271570a_100010253087_100010138639 [0,0,1,0,1,0|2,0,0]=4 1326 B20R2.18013 COC(=O)COc1cccc(c1)c2cnccc2C 271570a_100010253087_100000761580 [0,0,1,0,1,0|2,0,0]=4 1327 B20R2.18013 COC(=O)COc1cccc(c1)c2cnccc2C 271570a_100011935247_200000148702 [0,0,1,0,1,0|2,0,0]=4 1328 B20R2.18013 COC(=O)COc1cccc(c1)c2cnccc2Cl 271570a_100000062317_200000148702 [0,0,1,0,1,0|2,0,0]=4 1329 B20R2.18013 COC(=O)COc1cccc(c1)c2cnccc2Cl 271570a_100010253087_100009995489 [0,0,1,0,1,0|2,0,0]=4 1330 B20R2.18013 COC(=O)COc1cccc(c1)c2cnccc2F 271570a_100010253087_100009820683 [0,0,1,0,1,0|2,0,0]=4 1331 B20R2.18013 COC(=O)COc1cccc(c1)c2cnccc2N 271570a_100010253087_100000047001 [0,0,1,0,1,0|1,0,1]=4 1332 B20R2.18013 COC(=O)COc1cccc(c1)c2cnccc2N 271570a_200010248739_200000148702 [0,0,1,0,1,0|1,0,1]=4 1333 B20R2.18013 COC(=O)COc1cccc(c1)c2ncccc2Br 271570a_100010253087_100000696092 [0,0,1,0,1,0|2,0,0]=4 1334 B20R2.18013 COC(=O)COc1cccc(c1)c2ncccc2C 271570a_100010253087_100000751373 [0,0,1,0,1,0|2,0,0]=4 1335 B20R2.18013 COC(=O)COc1cccc(c1)c2ncccc2Cl 271570a_100009857861_200000148702 [0,0,1,0,1,0|2,0,0]=4 1336 B20R2.18013 COC(=O)COc1cccc(c1)c2ncccc2Cl 271570a_100010253087_100011356963 [0,0,1,0,1,0|2,0,0]=4 1337 B20R2.18013 COC(=O)COc1cccc(c1)c2ncccc2F 271570a_100010253087_100000685392 [0,0,1,0,1,0|2,0,0]=4 1338 B20R2.18013 COC(=O)COc1cccc(c1)c2ncccc2N 271570a_100010253087_100000688686 [0,0,1,0,1,0|1,0,1]=4 1339 B20R2.18013 COC(=O)COc1cccc(c1)c2ncccc2O 271570a_100010253087_100000034122 [0,0,1,0,1,0|2,0,0]=4 1340 B20R2.18013 COC(=O)CSc1cccc(c1)c2ccccc2C 271570a_100000747142_100011756034 [0,0,1,0,1,0|1,1,0]=4 1341 B20R2.18013 COC(=O)CSc1cccc(c1)c2ccccc2Cl 271570a_100011934419_100011756034 [0,0,1,0,1,0|1,1,0]=4 1342 B20R2.18013 COC(=O)CSc1cccc(c1)c2ccccc2F 271570a_100000761933_100011756034 [0,0,1,0,1,0|1,1,0]=4 1343 B20R2.18013 COC(=O)CSc1cccc(c1)c2ccccc2I 271570a_100000069755_100011756034 [0,0,1,0,1,0|1,1,0]=4 1344 B20R2.18013 COC(=O)CSc1cccc(c1)c2ccccc2N 271570a_100000034411_100011756034 [0,0,1,0,1,0|0,1,1]=4 1345 B20R2.18013 COC(=O)CSc1cccc(c1)c2ccccc2O 271570a_100000035170_100011756034 [0,0,1,0,1,0|1,1,0]=4 1346 B20R2.27371 COC(=O)Cc1cccc(c1)Sc2ccccc2Br 62a_100000695589_100000699549 [0,0,1,0,1,0|2,0,0]=4 1347 B20R2.27371 COC(=O)Cc1cccc(c1)Sc2ccccc2Br 62a_100000699549_100000695589 [0,0,1,0,1,0|2,0,0]=4 1348 B20R2.27371 COC(=O)Cc1cccc(c1)Sc2ccccc2C 62a_100000210755_100000699549 [0,0,1,0,1,0|2,0,0]=4 1349 B20R2.27371 COC(=O)Cc1cccc(c1)Sc2ccccc2C 62a_100000699549_100000210755 [0,0,1,0,1,0|2,0,0]=4 1350 B20R2.27371 COC(=O)Cc1cccc(c1)Sc2ccccc2Cl 62a_100000699549_100000764095 [0,0,1,0,1,0|2,0,0]=4 1351 B20R2.27371 COC(=O)Cc1cccc(c1)Sc2ccccc2Cl 62a_100000764095_100000699549 [0,0,1,0,1,0|2,0,0]=4 1352 B20R2.27371 COC(=O)Cc1cccc(c1)Sc2ccccc2F 62a_100000699549_100011215700 [0,0,1,0,1,0|2,0,0]=4 1353 B20R2.27371 COC(=O)Cc1cccc(c1)Sc2ccccc2F 62a_100011215700_100000699549 [0,0,1,0,1,0|2,0,0]=4 1354 B20R2.27371 COC(=O)Cc1cccc(c1)Sc2ccccc2N 62a_100000210017_100000699549 [0,0,1,0,1,0|1,0,1]=4 1355 B20R2.27371 COC(=O)Cc1cccc(c1)Sc2ccccc2N 62a_100000699549_100000210017 [0,0,1,0,1,0|1,0,1]=4 1356 B20R2.27371 COC(=O)Cc1cccc(c1)Sc2ccccc2O 62a_100000699549_100000739446 [0,0,1,0,1,0|2,0,0]=4 1357 B20R2.27371 COC(=O)Cc1cccc(c1)Sc2ccccc2O 62a_100000739446_100000699549 [0,0,1,0,1,0|2,0,0]=4 1358 B20R2.251822 COC(=O)Cc1cccc(c1Sc2ccccc2)C 62a_100000719477_200010150888 [0,0,1,0,1,0|2,0,0]=4 1359 B20R2.251822 COC(=O)Cc1cccc(c1Sc2ccccc2)C 62a_200010150888_100000041952 [0,0,1,0,1,0|2,0,0]=4 1360 B20R2.18069 CCC(=O)COc1ccccc1c2ccccc2C 7a_200011997984_100000747405 [0,0,1,0,1,0|2,0,0]=4 1361 B20R2.18069 CNC(=O)COc1ccccc1c2ccccc2C 271570a_100000747142_200000148481 [0,0,1,0,1,0|2,0,0]=4 1362 B20R2.18069 CNC(=O)COc1ccccc1c2ccccc2C 34a_200011997984_100000183359 [0,0,1,0,1,0|2,0,0]=4 1363 B20R2.18069 CNC(=O)COc1ccccc1c2ccccc2C 7a_200011997984_100000183359 [0,0,1,0,1,0|2,0,0]=4 1364 B20R2.18069 CNC(=O)COc1ccccc1c2ccccc2Cl 271570a_100011934419_200000148481 [0,0,1,0,1,0|2,0,0]=4 1365 B20R2.18069 CNC(=O)COc1ccccc1c2ccccc2F 271570a_100000761933_200000148481 [0,0,1,0,1,0|2,0,0]=4 1366 B20R2.18069 CNC(=O)COc1ccccc1c2ccccc2I 271570a_100000069755_200000148481 [0,0,1,0,1,0|2,0,0]=4 1367 B20R2.18069 CNC(=O)COc1ccccc1c2ccccc2N 271570a_100000034411_200000148481 [0,0,1,0,1,0|1,0,1]=4 1368 B20R2.18069 CNC(=O)COc1ccccc1c2ccccc2O 271570a_100000035170_200000148481 [0,0,1,0,1,0|2,0,0]=4 1369 B20R2.18069 COC(=O)CCc1ccccc1c2ccccc2Br 271570a_100010073835_100000695589 [0,0,1,0,1,0|2,0,0]=4 1370 B20R2.18069 COC(=O)CCc1ccccc1c2ccccc2C 271570a_100000747142_100009815308 [0,0,1,0,1,0|2,0,0]=4 1371 B20R2.18069 COC(=O)CCc1ccccc1c2ccccc2C 271570a_100010073835_100000210755 [0,0,1,0,1,0|2,0,0]=4 1372 B20R2.18069 COC(=O)CCc1ccccc1c2ccccc2Cl 271570a_100010073835_100000764095 [0,0,1,0,1,0|2,0,0]=4 1373 B20R2.18069 COC(=O)CCc1ccccc1c2ccccc2Cl 271570a_100011934419_100009815308 [0,0,1,0,1,0|2,0,0]=4 1374 B20R2.18069 COC(=O)CCc1ccccc1c2ccccc2F 271570a_100000761933_100009815308 [0,0,1,0,1,0|2,0,0]=4 1375 B20R2.18069 COC(=O)CCc1ccccc1c2ccccc2F 271570a_100010073835_100011215700 [0,0,1,0,1,0|2,0,0]=4 1376 B20R2.18069 COC(=O)CCc1ccccc1c2ccccc2I 271570a_100000069755_100009815308 [0,0,1,0,1,0|2,0,0]=4 1377 B20R2.18069 COC(=O)CCc1ccccc1c2ccccc2N 271570a_100000034411_100009815308 [0,0,1,0,1,0|1,0,1]=4 1378 B20R2.18069 COC(=O)CCc1ccccc1c2ccccc2N 271570a_100010073835_100000210017 [0,0,1,0,1,0|1,0,1]=4 1379 B20R2.18069 COC(=O)CCc1ccccc1c2ccccc2O 271570a_100000035170_100009815308 [0,0,1,0,1,0|2,0,0]=4 1380 B20R2.18069 COC(=O)CCc1ccccc1c2ccccc2O 271570a_100010073835_100000739446 [0,0,1,0,1,0|2,0,0]=4 1381 B20R2.18069 COC(=O)CNc1ccccc1c2ccccc2C 34a_100020605195_100000747449 [0,0,1,0,1,0|2,0,0]=4 1382 B20R2.18069 COC(=O)COc1ccccc1c2c[nH]ccc2=O 271570a_200010391582_100009998708 [0,0,1,0,1,0|2,0,0]=4 1383 B20R2.18069 COC(=O)COc1ccccc1c2c[nH]ccc2=S 271570a_200010391582_200012280681 [0,0,1,0,1,0|2,0,0]=4 1384 B20R2.18069 COC(=O)COc1ccccc1c2ccc[nH]c2=O 271570a_100000099769_200000173920 [0,0,1,0,1,0|2,0,0]=4 1385 B20R2.18069 COC(=O)COc1ccccc1c2ccc[nH]c2=O 271570a_200010391582_100000050042 [0,0,1,0,1,0|2,0,0]=4 1386 B20R2.18069 COC(=O)COc1ccccc1c2cccc[n+]2C 271570a_200010391582_100000212160 [0,0,1,0,1,0|2,0,0]=4 1387 B20R2.18069 COC(=O)COc1ccccc1c2cccc[n+]2[O-] 271570a_200010391582_200000042595 [0,0,1,0,1,0|2,0,0]=4 1388 B20R2.18069 COC(=O)COc1ccccc1c2ccccc2Br 271570a_200010391582_100000695589 [0,0,1,0,1,0|1,0,0]=3 1389 B20R2.18069 COC(=O)COc1ccccc1c2ccccc2C 271570a_100000747142_200000173920 [0,0,1,0,1,0|1,0,0]=3 1390 B20R2.18069 COC(=O)COc1ccccc1c2ccccc2C 271570a_200010391582_100000210755 [0,0,1,0,1,0|1,0,0]=3 1391 B20R2.18069 COC(=O)COc1ccccc1c2ccccc2C 34a_200011997984_100000747449 [0,0,1,0,1,0|1,0,0]=3 1392 B20R2.18069 COC(=O)COc1ccccc1c2ccccc2C 7a_200011997984_100000747449 [0,0,1,0,1,0|1,0,0]=3 1393 B20R2.18069 COC(=O)COc1ccccc1c2ccccc2Cl 271570a_100011934419_200000173920 [0,0,1,0,1,0|1,0,0]=3 1394 B20R2.18069 COC(=O)COc1ccccc1c2ccccc2Cl 271570a_200010391582_100000764095 [0,0,1,0,1,0|1,0,0]=3 1395 B20R2.18069 COC(=O)COc1ccccc1c2ccccc2F 271570a_100000761933_200000173920 [0,0,1,0,1,0|1,0,0]=3 1396 B20R2.18069 COC(=O)COc1ccccc1c2ccccc2F 271570a_200010391582_100011215700 [0,0,1,0,1,0|1,0,0]=3 1397 B20R2.18069 COC(=O)COc1ccccc1c2ccccc2I 271570a_100000069755_200000173920 [0,0,1,0,1,0|1,0,0]=3 1398 B20R2.18069 COC(=O)COc1ccccc1c2ccccc2N 271570a_100000034411_200000173920 [0,0,1,0,1,0|0,0,1]=3 1399 B20R2.18069 COC(=O)COc1ccccc1c2ccccc2N 271570a_200010391582_100000210017 [0,0,1,0,1,0|0,0,1]=3 1400 B20R2.18069 COC(=O)COc1ccccc1c2ccccc2O 271570a_100000035170_200000173920 [0,0,1,0,1,0|1,0,0]=3 1401 B20R2.18069 COC(=O)COc1ccccc1c2ccccc2O 271570a_200010391582_100000739446 [0,0,1,0,1,0|1,0,0]=3 1402 B20R2.18069 COC(=O)COc1ccccc1c2cccnc2Br 271570a_200010391582_100010202626 [0,0,1,0,1,0|2,0,0]=4 1403 B20R2.18069 COC(=O)COc1ccccc1c2cccnc2C 271570a_100011934933_200000173920 [0,0,1,0,1,0|2,0,0]=4 1404 B20R2.18069 COC(=O)COc1ccccc1c2cccnc2C 271570a_200010391582_100000751574 [0,0,1,0,1,0|2,0,0]=4 1405 B20R2.18069 COC(=O)COc1ccccc1c2cccnc2Cl 271570a_100000047009_200000173920 [0,0,1,0,1,0|2,0,0]=4 1406 B20R2.18069 COC(=O)COc1ccccc1c2cccnc2Cl 271570a_200010391582_100000036424 [0,0,1,0,1,0|2,0,0]=4 1407 B20R2.18069 COC(=O)COc1ccccc1c2cccnc2F 271570a_100000042387_200000173920 [0,0,1,0,1,0|2,0,0]=4 1408 B20R2.18069 COC(=O)COc1ccccc1c2cccnc2F 271570a_200010391582_100009816115 [0,0,1,0,1,0|2,0,0]=4 1409 B20R2.18069 COC(=O)COc1ccccc1c2cccnc2N 271570a_100000071976_200000173920 [0,0,1,0,1,0|1,0,1]=4 1410 B20R2.18069 COC(=O)COc1ccccc1c2cccnc2N 271570a_200010391582_100000045569 [0,0,1,0,1,0|1,0,1]=4 1411 B20R2.18069 COC(=O)COc1ccccc1c2ccncc2Br 271570a_200010391582_100000726257 [0,0,1,0,1,0|2,0,0]=4 1412 B20R2.18069 COC(=O)COc1ccccc1c2ccncc2C 271570a_100000701363_200000173920 [0,0,1,0,1,0|2,0,0]=4 1413 B20R2.18069 COC(=O)COc1ccccc1c2ccncc2C 271570a_200010391582_100015191297 [0,0,1,0,1,0|2,0,0]=4 1414 B20R2.18069 COC(=O)COc1ccccc1c2ccncc2Cl 271570a_100000062318_200000173920 [0,0,1,0,1,0|2,0,0]=4 1415 B20R2.18069 COC(=O)COc1ccccc1c2ccncc2Cl 271570a_200010391582_100000708259 [0,0,1,0,1,0|2,0,0]=4 1416 B20R2.18069 COC(=O)COc1ccccc1c2ccncc2F 271570a_100011290801_200000173920 [0,0,1,0,1,0|2,0,0]=4 1417 B20R2.18069 COC(=O)COc1ccccc1c2ccncc2F 271570a_200010391582_100000047030 [0,0,1,0,1,0|2,0,0]=4 1418 B20R2.18069 COC(=O)COc1ccccc1c2ccncc2N 271570a_200010391582_100009815883 [0,0,1,0,1,0|1,0,1]=4 1419 B20R2.18069 COC(=O)COc1ccccc1c2ccncc2O 271570a_200010391582_100009817591 [0,0,1,0,1,0|2,0,0]=4 1420 B20R2.18069 COC(=O)COc1ccccc1c2cnccc2Br 271570a_200010391582_100010138639 [0,0,1,0,1,0|2,0,0]=4 1421 B20R2.18069 COC(=O)COc1ccccc1c2cnccc2C 271570a_100011935247_200000173920 [0,0,1,0,1,0|2,0,0]=4 1422 B20R2.18069 COC(=O)COc1ccccc1c2cnccc2C 271570a_200010391582_100000761580 [0,0,1,0,1,0|2,0,0]=4 1423 B20R2.18069 COC(=O)COc1ccccc1c2cnccc2Cl 271570a_100000062317_200000173920 [0,0,1,0,1,0|2,0,0]=4 1424 B20R2.18069 COC(=O)COc1ccccc1c2cnccc2Cl 271570a_200010391582_100009995489 [0,0,1,0,1,0|2,0,0]=4 1425 B20R2.18069 COC(=O)COc1ccccc1c2cnccc2F 271570a_200010391582_100009820683 [0,0,1,0,1,0|2,0,0]=4 1426 B20R2.18069 COC(=O)COc1ccccc1c2cnccc2N 271570a_200010248739_200000173920 [0,0,1,0,1,0|1,0,1]=4 1427 B20R2.18069 COC(=O)COc1ccccc1c2cnccc2N 271570a_200010391582_100000047001 [0,0,1,0,1,0|1,0,1]=4 1428 B20R2.18069 COC(=O)COc1ccccc1c2ncccc2Br 271570a_200010391582_100000696092 [0,0,1,0,1,0|2,0,0]=4 1429 B20R2.18069 COC(=O)COc1ccccc1c2ncccc2C 271570a_200010391582_100000751373 [0,0,1,0,1,0|2,0,0]=4 1430 B20R2.18069 COC(=O)COc1ccccc1c2ncccc2Cl 271570a_100009857861_200000173920 [0,0,1,0,1,0|2,0,0]=4 1431 B20R2.18069 COC(=O)COc1ccccc1c2ncccc2Cl 271570a_200010391582_100011356963 [0,0,1,0,1,0|2,0,0]=4 1432 B20R2.18069 COC(=O)COc1ccccc1c2ncccc2F 271570a_200010391582_100000685392 [0,0,1,0,1,0|2,0,0]=4 1433 B20R2.18069 COC(=O)COc1ccccc1c2ncccc2N 271570a_200010391582_100000688686 [0,0,1,0,1,0|1,0,1]=4 1434 B20R2.18069 COC(=O)COc1ccccc1c2ncccc2O 271570a_200010391582_100000034122 [0,0,1,0,1,0|2,0,0]=4 1435 B20R2.251847 COC(=O)Cc1ccccc1Sc2ccccc2Br 62a_100000695589_100000699816 [0,0,1,0,1,0|2,0,0]=4 1436 B20R2.251847 COC(=O)Cc1ccccc1Sc2ccccc2Br 62a_100000699816_100000695589 [0,0,1,0,1,0|2,0,0]=4 1437 B20R2.251847 COC(=O)Cc1ccccc1Sc2ccccc2C 62a_100000210755_100000699816 [0,0,1,0,1,0|2,0,0]=4 1438 B20R2.251847 COC(=O)Cc1ccccc1Sc2ccccc2C 62a_100000699816_100000210755 [0,0,1,0,1,0|2,0,0]=4 1439 B20R2.251847 COC(=O)Cc1ccccc1Sc2ccccc2Cl 62a_100000699816_100000764095 [0,0,1,0,1,0|2,0,0]=4 1440 B20R2.251847 COC(=O)Cc1ccccc1Sc2ccccc2Cl 62a_100000764095_100000699816 [0,0,1,0,1,0|2,0,0]=4 1441 B20R2.251847 COC(=O)Cc1ccccc1Sc2ccccc2F 62a_100000699816_100011215700 [0,0,1,0,1,0|2,0,0]=4 1442 B20R2.251847 COC(=O)Cc1ccccc1Sc2ccccc2F 62a_100011215700_100000699816 [0,0,1,0,1,0|2,0,0]=4 1443 B20R2.251847 COC(=O)Cc1ccccc1Sc2ccccc2N 62a_100000210017_100000699816 [0,0,1,0,1,0|1,0,1]=4 1444 B20R2.251847 COC(=O)Cc1ccccc1Sc2ccccc2N 62a_100000699816_100000210017 [0,0,1,0,1,0|1,0,1]=4 1445 B20R2.251847 COC(=O)Cc1ccccc1Sc2ccccc2O 62a_100000699816_100000739446 [0,0,1,0,1,0|2,0,0]=4 1446 B20R2.251847 COC(=O)Cc1ccccc1Sc2ccccc2O 62a_100000739446_100000699816 [0,0,1,0,1,0|2,0,0]=4 1447 B20R3.31261 C/C=C/COc1cccc2c1oc3c2cccc3 34a_100010256078_100102629194 [1,0,0,0,1,0|2,0,0]=4 1448 B20R3.31261 C/C=C/COc1cccc2c1oc3c2cccc3 7a_100010256078_100102629194 [1,0,0,0,1,0|2,0,0]=4 1449 B20R3.31261 CC=CCOc1cccc2c1oc3c2cccc3 34a_100010256078_100000070051 [1,0,0,0,1,0|2,0,0]=4 1450 B20R3.31261 CC=CCOc1cccc2c1oc3c2cccc3 7a_100010256078_100000070051 [1,0,0,0,1,0|2,0,0]=4 1451 B20R3.31261 COCCOc1cccc2c1oc3c2cccc3 34a_100010256078_100011201679 [1,0,0,0,1,0|1,0,1]=4 1452 B20R3.31261 COCCOc1cccc2c1oc3c2cccc3 7a_100010256078_100000233755 [1,0,0,0,1,0|1,0,1]=4 1453 B20R3.2045325 C/C=C/COc1cccc2c1c3c(o2)cccc3 34a_100010256132_100102629194 [1,0,0,0,1,0|2,0,0]=4 1454 B20R3.2045325 C/C=C/COc1cccc2c1c3c(o2)cccc3 7a_100010256132_100102629194 [1,0,0,0,1,0|2,0,0]=4 1455 B20R3.2045325 CC=CCOc1cccc2c1c3c(o2)cccc3 34a_100010256132_100000070051 [1,0,0,0,1,0|2,0,0]=4 1456 B20R3.2045325 CC=CCOc1cccc2c1c3c(o2)cccc3 7a_100010256132_100000070051 [1,0,0,0,1,0|2,0,0]=4 1457 B20R3.2045325 COCCOc1cccc2c1c3c(o2)cccc3 34a_100010256132_100011201679 [1,0,0,0,1,0|1,0,1]=4 1458 B20R3.2045325 COCCOc1cccc2c1c3c(o2)cccc3 7a_100010256132_100000233755 [1,0,0,0,1,0|1,0,1]=4 1459 B20R3.426858 C=C(C)COc1cccc2c1oc3c2cccc3 34a_100010256078_100000748629 [1,0,0,0,1,0|2,0,0]=4 1460 B20R3.426858 C=C(C)COc1cccc2c1oc3c2cccc3 7a_100010256078_100000748629 [1,0,0,0,1,0|2,0,0]=4 1461 B20R3.426858 NC(=O)COc1cccc2c1oc3c2cccc3 34a_100010256078_100000187820 [1,0,0,0,1,0|2,0,0]=4 1462 B20R3.426858 NC(=O)COc1cccc2c1oc3c2cccc3 7a_100010256078_100000187820 [1,0,0,0,1,0|2,0,0]=4 1463 B20R3.426858 O=C([O-])COc1cccc2c1oc3c2cccc3 34a_100010256078_100020667443 [1,0,0,0,1,0|1,0,1]=4 1464 B20R3.652936 C=C(C)COc1cccc2c1c3c(o2)cccc3 34a_100010256132_100000748629 [1,0,0,0,1,0|2,0,0]=4 1465 B20R3.652936 C=C(C)COc1cccc2c1c3c(o2)cccc3 7a_100010256132_100000748629 [1,0,0,0,1,0|2,0,0]=4 1466 B20R3.652936 NC(=O)COc1cccc2c1c3c(o2)cccc3 34a_100010256132_100000187820 [1,0,0,0,1,0|2,0,0]=4 1467 B20R3.652936 NC(=O)COc1cccc2c1c3c(o2)cccc3 7a_100010256132_100000187820 [1,0,0,0,1,0|2,0,0]=4 1468 B20R3.652936 O=C([O-])COc1cccc2c1c3c(o2)cccc3 34a_100010256132_100020667443 [1,0,0,0,1,0|1,0,1]=4 1469 B20R3.5070115 CC(=Cc1cccc2c1nc3c(n2)cccc3)C 271570a_100102525489_100010275551 [1,0,0,0,1,0|1,0,1]=4 1470 B20R3.5070115 CC(=O)Nc1cccc2c1nc3c(c2)cccc3 11a_200000072084_100015343762 [1,0,0,0,1,0|2,0,0]=4 1471 B20R3.5070115 CC(=O)Nc1cccc2c1nc3c(c2)cccc3 1626a_200000072084_100015343762 [1,0,0,0,1,0|2,0,0]=4 1472 B20R3.5070115 CC(=O)Nc1cccc2c1nc3c(c2)cccc3 22a_200000072084_100000070787 [1,0,0,0,1,0|2,0,0]=4 1473 B20R3.5070115 CC(=O)Nc1cccc2c1nc3c(c2)cccc3 527a_200000072084_100103153847 [1,0,0,0,1,0|2,0,0]=4 1474 B20R3.5070115 CC(=O)Nc1cccc2c1nc3c(n2)cccc3 11a_100000029703_100015343762 [1,0,0,0,1,0|1,0,0]=3 1475 B20R3.5070115 CC(=O)Nc1cccc2c1nc3c(n2)cccc3 1626a_100000029703_100015343762 [1,0,0,0,1,0|1,0,0]=3 1476 B20R3.5070115 CC(C)Oc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100000210206 [1,0,0,0,1,0|1,0,1]=4 1477 B20R3.5938251 CCC(=O)c1cccc2c1nc3c(c2)cccc3 1458a_100020631721_100000210202 [0,0,0,0,2,0|2,0,0]=4 1478 B20R3.5938251 CCC(=O)c1cccc2c1nc3c(n2)cccc3 1458a_200016989829_100000210202 [0,0,0,0,2,0|1,0,0]=3 1479 B20R3.5938251 CNC(=O)c1cccc2c1nc3c(c2)cccc3 11a_106832991635_100020631721 [0,0,0,0,2,0|2,0,0]=4 1480 B20R3.5938251 CNC(=O)c1cccc2c1nc3c(c2)cccc3 240690a_100102657272_100020631721 [0,0,0,0,2,0|2,0,0]=4 1481 B20R3.5938251 CNC(=O)c1cccc2c1nc3c(n2)cccc3 11a_106832991635_200016989829 [0,0,0,0,2,0|1,0,0]=3 1482 B20R3.5938251 CNC(=O)c1cccc2c1nc3c(n2)cccc3 240690a_100102657272_200016989829 [0,0,0,0,2,0|1,0,0]=3 1483 B20R3.5938251 O=C(CF)c1cccc2c1nc3c(n2)cccc3 1458a_200016989829_100015361967 [0,0,0,0,2,0|2,0,0]=4 1484 B22R2.591325 COC(=O)COc1cccc(c1)C=Cc2ccccc2F 271570a_200102527919_200000148702 [0,0,1,0,0,1|2,0,0]=4 1485 B22R2.591325 COC(=O)COc1cccc(c1)SCc2ccccc2Br 62a_100000184730_200000148702 [0,0,1,0,0,1|2,0,0]=4 1486 B22R2.591325 COC(=O)COc1cccc(c1)SCc2ccccc2Br 62a_200000148702_100000184730 [0,0,1,0,0,1|2,0,0]=4 1487 B22R2.591325 COC(=O)COc1cccc(c1)SCc2ccccc2C 62a_100000211839_200000148702 [0,0,1,0,0,1|2,0,0]=4 1488 B22R2.591325 COC(=O)COc1cccc(c1)SCc2ccccc2C 62a_200000148702_100000211839 [0,0,1,0,0,1|2,0,0]=4 1489 B22R2.591325 COC(=O)COc1cccc(c1)SCc2ccccc2Cl 62a_100000187162_200000148702 [0,0,1,0,0,1|2,0,0]=4 1490 B22R2.591325 COC(=O)COc1cccc(c1)SCc2ccccc2Cl 62a_200000148702_100000187162 [0,0,1,0,0,1|2,0,0]=4 1491 B22R2.591325 COC(=O)COc1cccc(c1)SCc2ccccc2F 62a_100000211605_200000148702 [0,0,1,0,0,1|2,0,0]=4 1492 B22R2.591325 COC(=O)COc1cccc(c1)SCc2ccccc2F 62a_200000148702_100000211605 [0,0,1,0,0,1|2,0,0]=4 1493 B22R2.591325 COC(=O)COc1cccc(c1)SCc2ccccc2I 62a_100011216222_200000148702 [0,0,1,0,0,1|2,0,0]=4 1494 B22R2.591325 COC(=O)COc1cccc(c1)SCc2ccccc2I 62a_200000148702_100011216222 [0,0,1,0,0,1|2,0,0]=4 1495 B22R2.593383 COC(=O)COc1ccccc1C=Cc2ccccc2F 271570a_200102527919_200000173920 [0,0,1,0,0,1|2,0,0]=4 1496 B22R2.593383 COC(=O)COc1ccccc1CNc2ccccc2C 270302a_100015192222_100000148977 [0,0,1,0,0,1|1,0,1]=4 1497 B22R2.593383 COC(=O)COc1ccccc1SCc2ccccc2Br 62a_100000184730_200000173920 [0,0,1,0,0,1|2,0,0]=4 1498 B22R2.593383 COC(=O)COc1ccccc1SCc2ccccc2Br 62a_200000173920_100000184730 [0,0,1,0,0,1|2,0,0]=4 1499 B22R2.593383 COC(=O)COc1ccccc1SCc2ccccc2C 62a_100000211839_200000173920 [0,0,1,0,0,1|2,0,0]=4 1500 B22R2.593383 COC(=O)COc1ccccc1SCc2ccccc2C 62a_200000173920_100000211839 [0,0,1,0,0,1|2,0,0]=4 1501 B22R2.593383 COC(=O)COc1ccccc1SCc2ccccc2Cl 62a_100000187162_200000173920 [0,0,1,0,0,1|2,0,0]=4 1502 B22R2.593383 COC(=O)COc1ccccc1SCc2ccccc2Cl 62a_200000173920_100000187162 [0,0,1,0,0,1|2,0,0]=4 1503 B22R2.593383 COC(=O)COc1ccccc1SCc2ccccc2F 62a_100000211605_200000173920 [0,0,1,0,0,1|2,0,0]=4 1504 B22R2.593383 COC(=O)COc1ccccc1SCc2ccccc2F 62a_200000173920_100000211605 [0,0,1,0,0,1|2,0,0]=4 1505 B22R2.593383 COC(=O)COc1ccccc1SCc2ccccc2I 62a_100011216222_200000173920 [0,0,1,0,0,1|2,0,0]=4 1506 B22R2.593383 COC(=O)COc1ccccc1SCc2ccccc2I 62a_200000173920_100011216222 [0,0,1,0,0,1|2,0,0]=4 1507 B22R3.1099722 CNC(=O)CCOc1cccc2c1oc3c2cccc3 34a_100010256078_100012179268 [0,0,0,0,1,1|2,0,0]=4 1508 B22R3.1099722 CNC(=O)CCOc1cccc2c1oc3c2cccc3 7a_100010256078_100000737683 [0,0,0,0,1,1|2,0,0]=4 1509 B22R3.1099722 COC(=O)CCNc1cccc2c1oc3c2cccc3 34a_200000102501_100000742370 [0,0,0,0,1,1|2,0,0]=4 1510 B22R3.1099722 COC(=O)CCOc1cccc2c1oc3c2cccc3 34a_100010256078_100000742370 [0,0,0,0,1,1|1,0,0]=3 1511 B22R3.1099722 COC(=O)CCOc1cccc2c1oc3c2cccc3 7a_100010256078_100000204255 [0,0,0,0,1,1|1,0,0]=3 1512 B22R3.16276389 CNC(=O)CCOc1cccc2c1c3c(o2)cccc3 34a_100010256132_100012179268 [0,0,0,0,1,1|2,0,0]=4 1513 B22R3.16276389 CNC(=O)CCOc1cccc2c1c3c(o2)cccc3 7a_100010256132_100000737683 [0,0,0,0,1,1|2,0,0]=4 1514 B22R3.16276389 COC(=O)CCNc1cccc2c1c3c(o2)cccc3 34a_100009830322_100000742370 [0,0,0,0,1,1|2,0,0]=4 1515 B22R3.16276389 COC(=O)CCOc1cccc2c1c3c(o2)cccc3 34a_100010256132_100000742370 [0,0,0,0,1,1|1,0,0]=3 1516 B22R3.16276389 COC(=O)CCOc1cccc2c1c3c(o2)cccc3 7a_100010256132_100000204255 [0,0,0,0,1,1|1,0,0]=3 1517 B24R3.38167814 C=CC(=O)OCCOc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100009813456 [0,0,0,0,0,2|1,0,1]=4 1518 B24R3.38167814 CCC(=O)NCCNc1cccc2c1nc3c(n2)cccc3 27a_100132302217_100010275551 [0,0,0,0,0,2|2,0,0]=4 1519 B24R3.38167814 CNC(=O)CCCNc1cccc2c1nc3c(n2)cccc3 27a_100000740002_100010275551 [0,0,0,0,0,2|2,0,0]=4 1520 B24R3.38167814 CNC(=O)CCCOc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100000741757 [0,0,0,0,0,2|1,0,0]=3 1521 B24R3.38167814 CNC(=O)NCCNc1cccc2c1nc3c(n2)cccc3 27a_100015205895_100010275551 [0,0,0,0,0,2|2,0,0]=4 1522 B24R3.38167814 CNC(=O)OCCOc1cccc2c1nc3c(n2)cccc3 34a_100000029702_200011997002 [0,0,0,0,0,2|1,0,0]=3 1523 B24R3.38167814 COC(=O)/C=C/CNc1cccc2c1nc3c(c2)cccc3 34a_200000072084_100000742655 [0,0,0,0,0,2|2,0,0]=4 1524 B24R3.38167814 COC(=O)/C=C/COc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100000742655 [0,0,0,0,0,2|0,0,0]=2 1525 B24R3.38167814 COC(=O)CCCNc1cccc2c1nc3c(c2)cccc3 34a_200000072084_100000742333 [0,0,0,0,0,2|2,0,0]=4 1526 B24R3.38167814 COC(=O)CCCOc1cccc2c1nc3c(n2)cccc3 34a_100000029702_100000742333 [0,0,0,0,0,2|0,0,0]=2