0 B21R2.257631 O=C(CCCOc1ccccc1)NCc2ccccc2 CSC000153083 [0,0,0,0,0,0|3,0,1]=4 1 B21R2.257631 O=C(CCCOc1ccccc1)NNc2ccccc2 CSC046129967 [0,0,0,0,0,0|4,0,0]=4 2 B21R2.257631 O=C(CCSCc1ccccc1)NCc2ccccc2 CSC047473305 [0,0,0,0,0,0|3,0,1]=4 3 B21R2.257631 O=C(CCc1ccccc1)NCCCc2ccccc2 CSC046107996 [0,0,0,0,0,0|1,0,2]=3 4 B21R2.257631 O=C(CCc1ccccc1)NCCOc2ccccc2 CSC046116198 [0,0,0,0,0,0|2,0,2]=4 5 B21R2.257631 O=C(CCc1ccccc1)NCCSc2ccccc2 CSC046264962 [0,0,0,0,0,0|2,0,2]=4 6 B21R2.257631 O=C(COc1ccccc1)NCCCc2ccccc2 CSC046742093 [0,0,0,0,0,0|2,0,1]=3 7 B21R2.257631 O=C(COc1ccccc1)NCCOc2ccccc2 CSC046132823 [0,0,0,0,0,0|3,0,1]=4 8 B21R2.257631 O=C(COc1ccccc1)NCCSc2ccccc2 CSC046135981 [0,0,0,0,0,0|3,0,1]=4 9 B21R2.257631 O=C(CSc1ccccc1)NCCOc2ccccc2 CSC046178431 [0,0,0,0,0,0|3,0,1]=4 10 B21R2.257631 O=C(CSc1ccccc1)NCCSc2ccccc2 CSC046142084 [0,0,0,0,0,0|3,0,1]=4 11 B21R2.257631 O=C(NCC#Cc1ccccc1)C=Cc2ccccc2 CSC046213619 [0,0,0,0,0,0|1,0,2]=3 12 B22R2.4392 Clc1ccc(cc1)CCCNC(=O)CCc2ccccc2 CSC047596565 [0,1,0,0,0,0|1,0,2]=4 13 B22R2.4392 Clc1ccc(cc1)CCCNC(=O)COc2ccccc2 CSC048552838 [0,1,0,0,0,0|2,0,1]=4 14 B22R2.4392 Clc1ccc(cc1)CCCNC(=O)CSc2ccccc2 CSC047392421 [0,1,0,0,0,0|2,0,1]=4 15 B22R2.4541 Cc1cccc(c1)OCCOC(=O)C=Cc2ccccc2 CSC046108434 [0,1,0,0,0,0|1,0,0]=2 16 B22R2.23174 Brc1ccc(cc1)OCC(=O)NCCCc2ccccc2 CSC047222603 [0,1,0,0,0,0|2,0,1]=4 17 B22R2.23174 Cc1ccc(cc1)OCC(=O)NCCCc2ccccc2 CSC048039656 [0,1,0,0,0,0|2,0,1]=4 18 B22R2.23174 Cc1ccc(cc1)SCC(=O)NCCCc2ccccc2 CSC046755370 [0,1,0,0,0,0|2,0,1]=4 19 B22R2.23174 Clc1ccc(cc1)CCC(=O)NCCCc2ccccc2 CSC047905801 [0,1,0,0,0,0|1,0,2]=4 20 B22R2.23174 Clc1ccc(cc1)OCC(=O)NCCCc2ccccc2 CSC046112881 [0,1,0,0,0,0|2,0,1]=4 21 B22R2.23174 Clc1ccc(cc1)SCC(=O)NCCCc2ccccc2 CSC046697813 [0,1,0,0,0,0|2,0,1]=4 22 B22R2.23174 Fc1ccc(cc1)CCC(=O)NCCCc2ccccc2 CSC047889252 [0,1,0,0,0,0|1,0,2]=4 23 B22R2.23174 Fc1ccc(cc1)OCC(=O)NCCCc2ccccc2 CSC046090837 [0,1,0,0,0,0|2,0,1]=4 24 B22R2.23174 Ic1ccc(cc1)OCC(=O)NCCCc2ccccc2 CSC047460240 [0,1,0,0,0,0|2,0,1]=4 25 B22R2.34114 CC(CCc1ccccc1)NC(=O)CCc2ccccc2 CSC046216344 [0,1,0,0,0,0|1,0,2]=4 26 B22R2.34114 CC(CCc1ccccc1)NC(=O)COc2ccccc2 CSC046148097 [0,1,0,0,0,0|2,0,1]=4 27 B22R2.34137 OC(CNC(=O)NCc1ccccc1)Cc2ccccc2 CSC044064051 [0,1,0,0,0,0|2,0,1]=4 28 B22R2.202375 Cc1ccccc1OCC(=O)NCCCc2ccccc2 CSC046590562 [0,1,0,0,0,0|2,0,1]=4 29 B22R2.202375 Clc1ccccc1CCC(=O)NCCCc2ccccc2 CSC048953092 [0,1,0,0,0,0|1,0,2]=4 30 B22R2.202375 Clc1ccccc1OCC(=O)NCCCc2ccccc2 CSC047419368 [0,1,0,0,0,0|2,0,1]=4 31 B22R2.202375 Fc1ccccc1CCC(=O)NCCCc2ccccc2 CSC046147622 [0,1,0,0,0,0|1,0,2]=4 32 B22R2.202375 Fc1ccccc1OCC(=O)NCCCc2ccccc2 CSC046234529 [0,1,0,0,0,0|2,0,1]=4 33 B22R2.202375 Nc1ccccc1CCC(=O)NCCCc2ccccc2 CSC057277888 [0,1,0,0,0,0|1,0,2]=4 34 B22R2.304425 Cc1cccc(c1)OCC(=O)NCCCc2ccccc2 CSC047834902 [0,1,0,0,0,0|2,0,1]=4 35 B22R2.359951 CC(Oc1ccccc1)C(=O)NCCCc2ccccc2 CSC046270015 [0,1,0,0,0,0|2,0,1]=4 36 B22R2.359951 NC(Cc1ccccc1)C(=O)NCCCc2ccccc2 CSC056744989 [0,1,0,0,0,0|1,0,2]=4 37 B22R2.359951 O=C(NCCCc1ccccc1)C(=O)Nc2ccccc2 CSC046932293 [0,1,0,0,0,0|2,0,0]=3 38 B22R2.359951 O=C(NCCCc1ccccc1)C(=O)Nc2cccnc2 CSC046456968 [0,1,0,0,0,0|3,0,0]=4 39 B22R2.359951 O=C(NCCOc1ccccc1)C(=O)Nc2ccccc2 CSC046117072 [0,1,0,0,0,0|3,0,0]=4 40 B22R2.359957 NC(CC(=O)NCCCc1ccccc1)c2ccccc2 CSC057633794 [0,1,0,0,0,0|1,0,2]=4 41 B22R2.360256 OC(CCNC(=O)CCc1ccccc1)c2ccccc2 CSC047830023 [0,1,0,0,0,0|1,0,2]=4 42 B22R2.360256 OC(CCNC(=O)NCc1ccccc1)c2ccccc2 CSC029509711 [0,1,0,0,0,0|2,0,1]=4 43 B22R3.63943 O=C(CCc1ccccc1)N2CCCc3c2cccc3 CSC046133347 [0,0,0,1,0,0|1,0,2]=4 44 B22R3.63943 O=C(COc1ccccc1)N2CCCc3c2cccc3 CSC046180737 [0,0,0,1,0,0|2,0,1]=4 45 B22R3.63943 O=C(CSc1ccccc1)N2CCCc3c2cccc3 CSC046159469 [0,0,0,1,0,0|2,0,1]=4 46 B20R2.10810 O=C(CCCOc1ccccc1)Nc2ccccc2 CSC043845623 [0,0,0,0,1,0|3,0,0]=4 47 B20R2.10810 O=C(CCSCc1ccccc1)Nc2ccccc2 CSC046177800 [0,0,0,0,1,0|3,0,0]=4 48 B20R2.10810 O=C(NCCCc1ccccc1)Nc2ccccc2 CSC046126118 [0,0,0,0,1,0|2,0,0]=3 49 B20R2.10810 O=C(NCCOc1ccccc1)Nc2ccccc2 CSC046149984 [0,0,0,0,1,0|3,0,0]=4 50 B20R2.10810 O=C(NCCSc1ccccc1)Nc2ccccc2 CSC048143358 [0,0,0,0,1,0|3,0,0]=4 51 B20R2.174735 O=C(CCCc1ccccc1)NCc2ccccc2 CSC000186435 [0,0,0,0,1,0|1,0,1]=3 52 B20R2.174735 O=C(CCCc1ccccc1)NCc2ccccn2 CSC048212016 [0,0,0,0,1,0|2,0,1]=4 53 B20R2.174735 O=C(CCCc1ccccc1)NCc2cccnc2 CSC046132080 [0,0,0,0,1,0|2,0,1]=4 54 B20R2.174735 O=C(CCCc1ccccc1)NCc2ccncc2 CSC046649342 [0,0,0,0,1,0|2,0,1]=4 55 B20R2.174735 O=C(CCOc1ccccc1)NCc2ccccc2 CSC000153283 [0,0,0,0,1,0|2,0,1]=4 56 B20R2.174735 O=C(CCSc1ccccc1)NCc2ccccc2 CSC000153273 [0,0,0,0,1,0|2,0,1]=4 57 B20R2.174735 O=C(COCc1ccccc1)NNc2ccccc2 CSC000007122 [0,0,0,0,1,0|3,0,0]=4 58 B20R2.174735 O=C(COc1ccccc1)NCCc2ccccc2 CSC046127650 [0,0,0,0,1,0|2,0,1]=4 59 B20R2.174735 O=C(CSCc1ccccc1)NCc2ccccc2 CSC000149391 [0,0,0,0,1,0|2,0,1]=4 60 B20R2.174735 O=C(CSc1ccccc1)NCCc2ccccc2 CSC046151604 [0,0,0,0,1,0|2,0,1]=4 61 B22R2.359960 O=C(CCCc1ccccc1)NCCCc2ccccc2 CSC046092008 [0,0,0,0,0,1|1,0,2]=4 62 B22R2.359960 O=C(CCSc1ccccc1)NCCCc2ccccc2 CSC047620551 [0,0,0,0,0,1|1,0,2]=4 63 B22R2.359960 O=C(CSCc1ccccc1)NCCCc2ccccc2 CSC048902452 [0,0,0,0,0,1|1,0,2]=4 64 B22R2.360319 O=C(CCc1ccccc1)NCCCCc2ccccc2 CSC047220223 [0,0,0,0,0,1|1,0,2]=4 65 B22R2.360319 O=C(CCc1ccccc1)NCCOCc2ccccc2 CSC046369208 [0,0,0,0,0,1|1,0,2]=4 66 B22R2.360319 O=C(COc1ccccc1)NCCCCc2ccccc2 CSC047588317 [0,0,0,0,0,1|2,0,1]=4 67 B22R2.360319 O=C(COc1ccccc1)NCCOCc2ccccc2 CSC048154084 [0,0,0,0,0,1|2,0,1]=4 68 B22R2.360319 O=C(CSc1ccccc1)NCCOCc2ccccc2 CSC046399920 [0,0,0,0,0,1|2,0,1]=4 69 B21R2.19850 Cc1ccc(cc1)CC(=O)NCCCc2ccccc2 CSC046243756 [0,1,0,0,1,0|1,0,1]=4 70 B21R2.19850 Cc1ccc(cc1)NC(=O)NCCCc2ccccc2 CSC046092550 [0,1,0,0,1,0|2,0,0]=4 71 B21R2.19850 Clc1ccc(cc1)CC(=O)NCCCc2ccccc2 CSC046108323 [0,1,0,0,1,0|1,0,1]=4 72 B21R2.19850 Fc1ccc(cc1)CC(=O)NCCCc2ccccc2 CSC046127265 [0,1,0,0,1,0|1,0,1]=4 73 B21R2.19850 Fc1ccc(cc1)NC(=O)NCCCc2ccccc2 CSC046837469 [0,1,0,0,1,0|2,0,0]=4 74 B21R2.27926 CC(CCc1ccccc1)NC(=O)Nc2ccccc2 CSC046133419 [0,1,0,0,1,0|2,0,0]=4 75 B21R2.142835 Brc1ccccc1NC(=O)NCCCc2ccccc2 CSC047748073 [0,1,0,0,1,0|2,0,0]=4 76 B21R2.142835 Clc1ccccc1CC(=O)NCCCc2ccccc2 CSC046116146 [0,1,0,0,1,0|1,0,1]=4 77 B21R2.142835 Clc1ccccc1NC(=O)NCCCc2ccccc2 CSC046577994 [0,1,0,0,1,0|2,0,0]=4 78 B21R2.142835 Fc1ccccc1CC(=O)NCCCc2ccccc2 CSC046208750 [0,1,0,0,1,0|1,0,1]=4 79 B21R2.4848 Clc1ccccc1CNC(=O)CCCc2ccccc2 CSC046147979 [0,1,0,0,1,0|1,0,1]=4 80 B21R2.18995 Cc1ccc(cc1)CNC(=O)CCCc2ccccc2 CSC046198896 [0,1,0,0,1,0|1,0,1]=4 81 B21R2.18995 Clc1ccc(cc1)CNC(=O)CCCc2ccccc2 CSC047393995 [0,1,0,0,1,0|1,0,1]=4 82 B21R2.18995 Fc1ccc(cc1)CNC(=O)CCCc2ccccc2 CSC047532061 [0,1,0,0,1,0|1,0,1]=4 83 B23R2.477428 O=C(NCCCc1ccccc1)C(=O)NCc2ccccc2 CSC000027748 [0,1,0,0,0,1|1,0,1]=4 84 B23R2.477864 O=C(NCCCCc1ccccc1)C(=O)Nc2ccccc2 CSC046504896 [0,1,0,0,0,1|2,0,0]=4 85 B23R2.478137 CN(CCOC(=O)COc1ccccc1)Cc2ccccc2 CSC029403412 [0,1,0,0,0,1|1,0,1]=4 86 B23R2.730753 Brc1ccc(cc1)NC(=O)C(=O)NCCCc2ccccc2 CSC048899111 [0,2,0,0,0,0|2,0,0]=4 87 B23R2.730753 Cc1ccc(cc1)NC(=O)C(=O)NCCCc2ccccc2 CSC046081936 [0,2,0,0,0,0|2,0,0]=4 88 B23R2.730753 Clc1ccc(cc1)NC(=O)C(=O)NCCCc2ccccc2 CSC047445938 [0,2,0,0,0,0|2,0,0]=4 89 B23R2.730753 Fc1ccc(cc1)NC(=O)C(=O)NCCCc2ccccc2 CSC048005379 [0,2,0,0,0,0|2,0,0]=4 90 B23R2.38413 CC(CCc1ccccc1)NC(=O)C(=O)Nc2ccccc2 CSC046222378 [0,2,0,0,0,0|2,0,0]=4 91 B23R2.269234 Brc1ccccc1NC(=O)C(=O)NCCCc2ccccc2 CSC048119807 [0,2,0,0,0,0|2,0,0]=4 92 B23R2.269234 Cc1ccccc1NC(=O)C(=O)NCCCc2ccccc2 CSC047329538 [0,2,0,0,0,0|2,0,0]=4 93 B23R2.269234 Clc1ccccc1NC(=O)C(=O)NCCCc2ccccc2 CSC046093720 [0,2,0,0,0,0|2,0,0]=4 94 B23R2.269234 Fc1ccccc1NC(=O)C(=O)NCCCc2ccccc2 CSC047250831 [0,2,0,0,0,0|2,0,0]=4 95 B23R2.174103 Cc1cccc(c1)NC(=O)C(=O)NCCCc2ccccc2 CSC046157354 [0,2,0,0,0,0|2,0,0]=4 96 B23R2.38433 OC(CCNC(=O)C(=O)Nc1ccccc1)c2ccccc2 CSC049058851 [0,2,0,0,0,0|2,0,0]=4 97 B21R3.3124 C(NCc1cccc2c1cccc2)c3ccccc3 CSC000186978 [1,0,0,1,0,0|2,0,0]=4 98 B23R3.19444762 O=C(NCCCc1ccccc1)c2cc3ccccc3o2 CSC048955677 [0,1,0,1,0,0|1,0,0]=3 99 B23R3.19444762 O=C(NCCCc1ccccc1)c2cc3ccccn3c2 CSC046643230 [0,1,0,1,0,0|2,0,0]=4 100 B23R3.19444762 O=C(NCCOc1ccccc1)c2cc3ccccc3o2 CSC046129576 [0,1,0,1,0,0|2,0,0]=4 101 B23R3.19444762 O=C(NCCSc1ccccc1)c2cc3ccccc3o2 CSC046761139 [0,1,0,1,0,0|2,0,0]=4 102 B19R2.2628 C(Cc1ccccc1)NCC=Cc2ccccc2 CSC000389765 [1,0,0,0,1,0|1,0,1]=4 103 B19R2.8899 O=C(NCCCc1ccccc1)c2ccccc2 CSC000578693 [0,0,0,0,2,0|1,0,0]=3 104 B19R2.8899 O=C(NCCCc1ccccc1)c2cccnc2 CSC046090739 [0,0,0,0,2,0|2,0,0]=4 105 B19R2.8900 O=C(CCCc1ccccc1)Nc2ccccc2 CSC032536753 [0,0,0,0,2,0|1,0,0]=3 106 B19R2.8900 O=C(CCCc1ccccc1)Nc2ccccn2 CSC046115095 [0,0,0,0,2,0|2,0,0]=4 107 B19R2.8900 O=C(CCCc1ccccc1)Nc2ccncc2 CSC046170958 [0,0,0,0,2,0|2,0,0]=4 108 B19R2.8900 O=C(CCOc1ccccc1)Nc2ccccc2 CSC000579960 [0,0,0,0,2,0|2,0,0]=4 109 B19R2.8900 O=C(CCSc1ccccc1)Nc2ccccc2 CSC000383247 [0,0,0,0,2,0|2,0,0]=4 110 B19R2.8900 O=C(NCCc1ccccc1)Nc2ccccc2 CSC046084794 [0,0,0,0,2,0|2,0,0]=4 111 B19R2.16162 O=C(CCc1ccccc1)NCc2ccccc2 CSC000153163 [0,0,0,0,2,0|1,0,1]=4 112 B19R2.16162 O=C(CCc1ccccc1)NNc2ccccc2 CSC046243588 [0,0,0,0,2,0|2,0,0]=4