0 B22R3.29187 CC(NCCn1c(=O)[nH]c2c1cccc2)c3cccs3 2230a_100000703493_203549783246 [0,0,0,0,0,0|3,0,1]=4 1 B22R3.29187 Cc1[nH]c2ccccc2c1C=NNC(=O)c3cc[nH]n3 4a_100011273208_100000186307 [0,0,0,0,0,0|3,0,1]=4 2 B22R3.29187 Cc1[nH]c2ccccc2c1C=NNC(=O)c3ccc[nH]3 4a_100000018271_100000186307 [0,0,0,0,0,0|2,0,1]=3 3 B22R3.29187 Cc1[nH]c2ccccc2c1C=NNC(=O)c3ccco3 4a_100000185077_100000186307 [0,0,0,0,0,0|1,1,1]=3 4 B22R3.29187 Cc1[nH]c2ccccc2c1C=NNC(=O)c3cccs3 4a_100000184746_100000186307 [0,0,0,0,0,0|1,0,1]=2 5 B22R3.29187 Cc1[nH]c2ccccc2c1C=NNC(=O)c3ccoc3 4a_100000233958_100000186307 [0,0,0,0,0,0|3,0,1]=4 6 B22R3.29187 Cc1[nH]c2ccccc2c1C=NNC(=O)c3ccsc3 4a_100000193922_100000186307 [0,0,0,0,0,0|3,0,1]=4 7 B22R3.29187 Cc1[nH]c2ccccc2c1C=NNC(=O)c3cnco3 4a_100000081316_100000186307 [0,0,0,0,0,0|2,1,1]=4 8 B22R3.29187 Cc1[nH]c2ccccc2c1C=NNC(=O)c3cncs3 4a_200000241815_100000186307 [0,0,0,0,0,0|2,0,1]=3 9 B22R3.29187 Cc1[nH]c2ccccc2c1C=NNC(=O)c3cocn3 4a_100000084333_100000186307 [0,0,0,0,0,0|3,0,1]=4 10 B22R3.29187 Cc1[nH]c2ccccc2c1C=NNC(=O)c3cscn3 4a_100011794543_100000186307 [0,0,0,0,0,0|3,0,1]=4 11 B22R3.29187 Cc1[nH]c2ccccc2c1C=NNC(=O)c3nccs3 4a_100000077877_100000186307 [0,0,0,0,0,0|2,0,1]=3 12 B22R3.29187 Cc1[nH]c2ccccc2c1CCNC(=O)C3=CCCC3 240690a_100000750322_100000038896 [0,0,0,0,0,0|1,0,2]=3 13 B22R3.29187 Cc1[nH]c2ccccc2c1CCNC(=O)C3=CCOC3 240690a_100000750322_100000139269 [0,0,0,0,0,0|2,0,1]=3 14 B22R3.29187 Cc1[nH]c2ccccc2c1CCNC(=O)C3=COCC3 240690a_100000750322_100000750620 [0,0,0,0,0,0|2,0,1]=3 15 B22R3.29187 Cc1[nH]c2ccccc2c1CCNC(=O)C3CC=CC3 240690a_100000750322_100000759439 [0,0,0,0,0,0|1,0,2]=3 16 B22R3.29187 Cc1[nH]c2ccccc2c1CCNC(=O)C3CC=CC3 527a_100000750322_100000759439 [0,0,0,0,0,0|1,0,2]=3 17 B22R3.29187 Cc1[nH]c2ccccc2c1CCNC(=O)C3CCCS3 240690a_100000750322_100012002731 [0,0,0,0,0,0|0,0,4]=4 18 B22R3.29187 Cc1[nH]c2ccccc2c1CCNC(=O)C3CCCS3 527a_100000750322_100012002731 [0,0,0,0,0,0|0,0,4]=4 19 B22R3.29187 Cc1[nH]c2ccccc2c1CCNC(=O)N3CC=CC3 2708a_100000750322_100015195280 [0,0,0,0,0,0|2,0,1]=3 20 B22R3.29187 Cc1[nH]c2ccccc2c1CCNC(=O)N3CC=CC3 273464a_100000750322_100015195280 [0,0,0,0,0,0|2,0,1]=3 21 B22R3.29187 Cc1[nH]c2ccccc2c1CCNC(C)c3cc[nH]c3 269862a_100000750322_100000753940 [0,0,0,0,0,0|3,0,1]=4 22 B22R3.29187 Cc1[nH]c2ccccc2c1CCNC(C)c3ccc[nH]3 269862a_100000750322_100000183661 [0,0,0,0,0,0|2,0,1]=3 23 B22R3.29187 Cc1[nH]c2ccccc2c1CCNC(C)c3cccs3 269862a_100000750322_100000185736 [0,0,0,0,0,0|1,0,1]=2 24 B22R3.29187 Cc1[nH]c2ccccc2c1CCNC(C)c3ccn[nH]3 269862a_100000750322_100000747476 [0,0,0,0,0,0|3,0,1]=4 25 B22R3.29187 Cc1[nH]c2ccccc2c1CCNC(C)c3ccsc3 269862a_100000750322_100000747891 [0,0,0,0,0,0|3,0,1]=4 26 B22R3.29187 Cc1[nH]c2ccccc2c1CCNC(C)c3cscn3 269862a_100000750322_100000693406 [0,0,0,0,0,0|3,0,1]=4 27 B22R3.29187 Cc1[nH]c2ccccc2c1CCNC(C)c3ncc[nH]3 269862a_100000750322_100000718901 [0,0,0,0,0,0|3,0,1]=4 28 B22R3.29187 Cc1[nH]c2ncccc2c1SCCC(=O)c3cccs3 62a_100011290775_100010174266 [0,0,0,0,0,0|3,0,0]=3 29 B22R3.29187 Cc1nc2ccccc2n1CCNC(C)c3cccs3 269862a_200000204690_100000185736 [0,0,0,0,0,0|2,0,2]=4 30 B22R3.29187 Cc1nc2ccccn2c1C=NNC(=O)c3cccs3 4a_100000184746_100000182234 [0,0,0,0,0,0|2,0,2]=4 31 B22R3.29187 Cc1nc2ccccn2c1SCCC(=O)c3cccs3 62a_100000762796_100011290775 [0,0,0,0,0,0|3,0,1]=4 32 B22R3.29187 Cc1nc2ccccn2c1SCCC(=O)c3cccs3 62a_100011290775_100000762796 [0,0,0,0,0,0|3,0,1]=4 33 B22R3.29187 Cc1oc2ccccc2c1SCCC(=O)c3cccs3 62a_100011290775_200010236113 [0,0,0,0,0,0|3,0,0]=3 34 B22R3.29187 Cc1sc2ccccc2c1C=NNC(=O)c3ccc[nH]3 4a_100000018271_100000066825 [0,0,0,0,0,0|3,0,1]=4 35 B22R3.29187 Cc1sc2ccccc2c1C=NNC(=O)c3ccco3 4a_100000185077_100000066825 [0,0,0,0,0,0|2,1,1]=4 36 B22R3.29187 Cc1sc2ccccc2c1C=NNC(=O)c3cccs3 4a_100000184746_100000066825 [0,0,0,0,0,0|2,0,1]=3 37 B22R3.29187 Cc1sc2ccccc2c1C=NNC(=O)c3cncs3 4a_200000241815_100000066825 [0,0,0,0,0,0|3,0,1]=4 38 B22R3.29187 Cc1sc2ccccc2c1C=NNC(=O)c3nccs3 4a_100000077877_100000066825 [0,0,0,0,0,0|3,0,1]=4 39 B22R3.29187 Cc1sc2ccccc2c1SCCC(=O)c3cccs3 62a_100010002616_100011290775 [0,0,0,0,0,0|3,0,0]=3 40 B22R3.29187 Cc1sc2ccccc2c1SCCC(=O)c3cccs3 62a_100011290775_100010002616 [0,0,0,0,0,0|3,0,0]=3 41 B22R3.29187 Cn1nc2ccccc2c1C=NNC(=O)c3cccs3 4a_100000184746_100000066482 [0,0,0,0,0,0|2,0,2]=4 42 B22R3.29187 Cn1nc2ccccc2c1SCCC(=O)c3cccs3 62a_100010163699_100011290775 [0,0,0,0,0,0|3,0,1]=4 43 B22R3.29187 Cn1nc2ccccc2c1SCCC(=O)c3cccs3 62a_100011290775_100010163699 [0,0,0,0,0,0|3,0,1]=4 44 B22R3.29187 O=C(CCSC1C(=O)Nc2c1cccc2)c3cccs3 62a_100011290775_200009996675 [0,0,0,0,0,0|3,0,1]=4 45 B22R3.29187 O=C(NN=CC1C(=O)Nc2c1cccc2)c3cccs3 4a_100000184746_100000076095 [0,0,0,0,0,0|2,0,2]=4 46 B22R3.29187 O=C(NN=Cc1c([nH]c2c1cccc2)Br)c3ccc[nH]3 4a_100000018271_100010159312 [0,0,0,0,0,0|3,0,1]=4 47 B22R3.29187 O=C(NN=Cc1c([nH]c2c1cccc2)Br)c3ccco3 4a_100000185077_100010159312 [0,0,0,0,0,0|2,1,1]=4 48 B22R3.29187 O=C(NN=Cc1c([nH]c2c1cccc2)Br)c3cccs3 4a_100000184746_100010159312 [0,0,0,0,0,0|2,0,1]=3 49 B22R3.29187 O=C(NN=Cc1c([nH]c2c1cccc2)Br)c3cncs3 4a_200000241815_100010159312 [0,0,0,0,0,0|3,0,1]=4 50 B22R3.29187 O=C(NN=Cc1c([nH]c2c1cccc2)Br)c3nccs3 4a_100000077877_100010159312 [0,0,0,0,0,0|3,0,1]=4 51 B22R3.29187 O=C(NN=Cc1c([nH]c2c1cccc2)Cl)c3ccc[nH]3 4a_100000018271_100000017700 [0,0,0,0,0,0|3,0,1]=4 52 B22R3.29187 O=C(NN=Cc1c([nH]c2c1cccc2)Cl)c3ccco3 4a_100000185077_100000017700 [0,0,0,0,0,0|2,1,1]=4 53 B22R3.29187 O=C(NN=Cc1c([nH]c2c1cccc2)Cl)c3cccs3 4a_100000184746_100000017700 [0,0,0,0,0,0|2,0,1]=3 54 B22R3.29187 O=C(NN=Cc1c([nH]c2c1cccc2)Cl)c3cncs3 4a_200000241815_100000017700 [0,0,0,0,0,0|3,0,1]=4 55 B22R3.29187 O=C(NN=Cc1c([nH]c2c1cccc2)Cl)c3nccs3 4a_100000077877_100000017700 [0,0,0,0,0,0|3,0,1]=4 56 B21R3.2809 CC(NCCc1c[nH]c2c1cccc2)c3ccc[nH]3 269862a_100000211132_100000183661 [1,0,0,0,0,0|2,0,1]=4 57 B21R3.2809 CC(NCCc1c[nH]c2c1cccc2)c3cccs3 2230a_100000703493_100011218569 [1,0,0,0,0,0|1,0,1]=3 58 B21R3.2809 CC(NCCc1c[nH]c2c1cccc2)c3cccs3 269862a_100000211132_100000185736 [1,0,0,0,0,0|1,0,1]=3 59 B21R3.2809 CC(NCCc1c[nH]c2c1cccc2)c3nccs3 2230a_100000725601_100011218569 [1,0,0,0,0,0|2,0,1]=4 60 B21R3.2809 CC(NCCc1c[nH]c2c1cccn2)c3cccs3 2230a_100000703493_100009895007 [1,0,0,0,0,0|2,0,1]=4 61 B21R3.2809 CC(NCCc1coc2c1cccc2)c3cccs3 269862a_100011934666_100000185736 [1,0,0,0,0,0|2,0,1]=4 62 B21R3.2809 C[C@@H](NCCc1c[nH]c2c1cccc2)c3ccco3 2230a_100160469435_100011218569 [1,0,0,0,0,0|1,1,1]=4 63 B21R3.2809 C[C@@H](OCCc1c[nH]c2c1cccc2)c3cccs3 7a_100000750433_100011218569 [1,0,0,0,0,0|2,0,1]=4 64 B21R3.2809 O=C(CCOc1csc2c1cccc2)c3cccs3 7a_100000077758_100011290775 [1,0,0,0,0,0|3,0,0]=4 65 B21R3.2809 O=C(CCSc1c[nH]c2c1cccn2)c3cccs3 62a_100011290775_100011934613 [1,0,0,0,0,0|3,0,0]=4 66 B21R3.2809 O=C(CCSc1c[nH]c2c1ccnc2)c3cccs3 62a_100011290775_100010232032 [1,0,0,0,0,0|3,0,0]=4 67 B21R3.2809 O=C(CCSc1c[nH]c2c1cncc2)c3cccs3 62a_100011290775_100000753697 [1,0,0,0,0,0|3,0,0]=4 68 B21R3.2809 O=C(CCSc1c[nH]c2c1nccc2)c3cccs3 62a_100011290775_100009817151 [1,0,0,0,0,0|3,0,0]=4 69 B21R3.2809 O=C(CCSc1coc2c1cccc2)c3cccs3 62a_100011290775_100009812202 [1,0,0,0,0,0|3,0,0]=4 70 B21R3.2809 O=C(CCSc1csc2c1cccc2)c3cccs3 62a_100011290775_100009813928 [1,0,0,0,0,0|3,0,0]=4 71 B21R3.2809 O=C(CCSc1n[nH]c2c1cccc2)c3cccs3 62a_100011290775_100000050141 [1,0,0,0,0,0|3,0,0]=4 72 B21R3.2809 O=C(CSCc1csc2c1cccc2)c3cccs3 62a_100000211436_200000742921 [1,0,0,0,0,0|3,0,0]=4 73 B21R3.2809 O=C(CSCc1csc2c1cccc2)c3cccs3 62a_200000742921_100000211436 [1,0,0,0,0,0|3,0,0]=4 74 B21R3.2809 O=C(NCCc1c[nH]c2c1cccc2)C3=CCCC3 240690a_100000211132_100000038896 [1,0,0,0,0,0|1,0,2]=4 75 B21R3.2809 O=C(NCCc1c[nH]c2c1cccc2)C3=CCOC3 240690a_100000211132_100000139269 [1,0,0,0,0,0|2,0,1]=4 76 B21R3.2809 O=C(NCCc1c[nH]c2c1cccc2)C3=COCC3 240690a_100000211132_100000750620 [1,0,0,0,0,0|2,0,1]=4 77 B21R3.2809 O=C(NCCc1c[nH]c2c1cccc2)C3CC=CC3 240690a_100000211132_100000759439 [1,0,0,0,0,0|1,0,2]=4 78 B21R3.2809 O=C(NCCc1c[nH]c2c1cccc2)C3CC=CC3 527a_100000211132_100000759439 [1,0,0,0,0,0|1,0,2]=4 79 B21R3.2809 O=C(NCCc1c[nH]c2c1cccc2)N3CC=CC3 2708a_100000211132_100015195280 [1,0,0,0,0,0|2,0,1]=4 80 B21R3.2809 O=C(NCCc1c[nH]c2c1cccc2)N3CC=CC3 273464a_100000211132_100015195280 [1,0,0,0,0,0|2,0,1]=4 81 B21R3.2809 O=C(NN=Cc1c[nH]c2c1cccc2)c3ccc[nH]3 4a_100000018271_100000182151 [1,0,0,0,0,0|2,0,1]=4 82 B21R3.2809 O=C(NN=Cc1c[nH]c2c1cccc2)c3ccco3 4a_100000185077_100000182151 [1,0,0,0,0,0|1,1,1]=4 83 B21R3.2809 O=C(NN=Cc1c[nH]c2c1cccc2)c3cccs3 4a_100000184746_100000182151 [1,0,0,0,0,0|1,0,1]=3 84 B21R3.2809 O=C(NN=Cc1c[nH]c2c1cccc2)c3cncs3 4a_200000241815_100000182151 [1,0,0,0,0,0|2,0,1]=4 85 B21R3.2809 O=C(NN=Cc1c[nH]c2c1cccc2)c3nccs3 4a_100000077877_100000182151 [1,0,0,0,0,0|2,0,1]=4 86 B21R3.2809 O=C(NN=Cc1c[nH]c2c1cccn2)c3cccs3 4a_100000184746_100000187067 [1,0,0,0,0,0|2,0,1]=4 87 B21R3.2809 O=C(NN=Cc1c[nH]c2c1ccnc2)c3cccs3 4a_100000184746_100000087688 [1,0,0,0,0,0|2,0,1]=4 88 B21R3.2809 O=C(NN=Cc1c[nH]c2c1cncc2)c3cccs3 4a_100000184746_100011787733 [1,0,0,0,0,0|2,0,1]=4 89 B21R3.2809 O=C(NN=Cc1c[nH]c2c1nccc2)c3cccs3 4a_100000184746_100000133833 [1,0,0,0,0,0|2,0,1]=4 90 B21R3.2809 O=C(NN=Cc1coc2c1cccc2)c3cccs3 4a_100000184746_100000688544 [1,0,0,0,0,0|2,0,1]=4 91 B21R3.2809 O=C(NN=Cc1csc2c1cccc2)c3cccs3 4a_100000184746_100000239721 [1,0,0,0,0,0|2,0,1]=4 92 B21R3.2809 O=C(NN=Cc1n[nH]c2c1cccc2)c3cccs3 4a_100000184746_100000059708 [1,0,0,0,0,0|2,0,1]=4 93 B21R3.19586 Cc1[nH]c2ccccc2c1CCNCc3cc[nH]n3 207a_100000750322_100000738523 [1,0,0,0,0,0|2,0,1]=4 94 B21R3.19586 Cc1[nH]c2ccccc2c1CCNCc3cc[nH]n3 270004a_100000750322_100000738523 [1,0,0,0,0,0|2,0,1]=4 95 B21R3.19586 Cc1[nH]c2ccccc2c1CCNCc3ccco3 207a_100000750322_100000186105 [1,0,0,0,0,0|0,1,1]=3 96 B21R3.19586 Cc1[nH]c2ccccc2c1CCNCc3ccco3 270004a_100000750322_100000186105 [1,0,0,0,0,0|0,1,1]=3 97 B21R3.19586 Cc1[nH]c2ccccc2c1CCNCc3cccs3 207a_100000750322_100000209959 [1,0,0,0,0,0|0,0,1]=2 98 B21R3.19586 Cc1[nH]c2ccccc2c1CCNCc3cccs3 270004a_100000750322_100000209959 [1,0,0,0,0,0|0,0,1]=2 99 B21R3.19586 Cc1[nH]c2ccccc2c1CCNCc3ccoc3 207a_100000750322_100011215517 [1,0,0,0,0,0|2,0,1]=4 100 B21R3.19586 Cc1[nH]c2ccccc2c1CCNCc3ccoc3 270004a_100000750322_100011215517 [1,0,0,0,0,0|2,0,1]=4 101 B21R3.19586 Cc1[nH]c2ccccc2c1CCNCc3ccsc3 207a_100000750322_100000188534 [1,0,0,0,0,0|2,0,1]=4 102 B21R3.19586 Cc1[nH]c2ccccc2c1CCNCc3ccsc3 270004a_100000750322_100000188534 [1,0,0,0,0,0|2,0,1]=4 103 B21R3.19586 Cc1[nH]c2ccccc2c1CCNCc3cnc[nH]3 207a_100000750322_100000742939 [1,0,0,0,0,0|2,0,1]=4 104 B21R3.19586 Cc1[nH]c2ccccc2c1CCNCc3cnco3 270004a_100000750322_100000064291 [1,0,0,0,0,0|1,1,1]=4 105 B21R3.19586 Cc1[nH]c2ccccc2c1CCNCc3cncs3 207a_100000750322_100000749870 [1,0,0,0,0,0|1,0,1]=3 106 B21R3.19586 Cc1[nH]c2ccccc2c1CCNCc3cncs3 270004a_100000750322_100000749870 [1,0,0,0,0,0|1,0,1]=3 107 B21R3.19586 Cc1[nH]c2ccccc2c1CCNCc3cocn3 270004a_100000750322_100000050382 [1,0,0,0,0,0|2,0,1]=4 108 B21R3.19586 Cc1[nH]c2ccccc2c1CCNCc3cscn3 207a_100000750322_100000743575 [1,0,0,0,0,0|2,0,1]=4 109 B21R3.19586 Cc1[nH]c2ccccc2c1CCNCc3cscn3 270004a_100000750322_100000743575 [1,0,0,0,0,0|2,0,1]=4 110 B21R3.19586 Cc1[nH]c2ccccc2c1CCNCc3ncc[nH]3 207a_100000750322_100000743867 [1,0,0,0,0,0|2,0,1]=4 111 B21R3.19586 Cc1[nH]c2ccccc2c1CCNCc3ncco3 270004a_100000750322_100000064290 [1,0,0,0,0,0|1,1,1]=4 112 B21R3.19586 Cc1[nH]c2ccccc2c1CCNCc3nccs3 207a_100000750322_100000750902 [1,0,0,0,0,0|1,0,1]=3 113 B21R3.19586 Cc1[nH]c2ccccc2c1CCNCc3nccs3 270004a_100000750322_100000750902 [1,0,0,0,0,0|1,0,1]=3 114 B21R3.19586 Cc1nc2ccccc2n1CCNCc3cccs3 207a_200000204690_100000209959 [1,0,0,0,0,0|1,0,2]=4 115 B21R3.19586 Cc1nc2ccccc2n1CCNCc3cccs3 270004a_200000204690_100000209959 [1,0,0,0,0,0|1,0,2]=4 116 B21R3.19586 O=c1[nH]c2ccccc2n1CCNCc3cccs3 207a_203549771432_100000209959 [1,0,0,0,0,0|2,0,1]=4 117 B21R3.19586 O=c1[nH]c2ccccc2n1CCNCc3cccs3 2230a_100000211653_203549783246 [1,0,0,0,0,0|2,0,1]=4 118 B21R3.19586 O=c1[nH]c2ccccc2n1CCNCc3cccs3 270004a_203549771432_100000209959 [1,0,0,0,0,0|2,0,1]=4 119 B23R3.40461 Cc1[nH]c2ccccc2c1CCNS(=O)(=O)c3c[nH]cn3 270084a_100000750322_100000754927 [0,1,0,0,0,0|3,0,0]=4 120 B23R3.40461 Cc1[nH]c2ccccc2c1CCNS(=O)(=O)c3c[nH]cn3 274078a_100000750322_100000754927 [0,1,0,0,0,0|3,0,0]=4 121 B23R3.40461 Cc1[nH]c2ccccc2c1CCNS(=O)(=O)c3ccco3 270084a_100000750322_200000702926 [0,1,0,0,0,0|1,1,0]=3 122 B23R3.40461 Cc1[nH]c2ccccc2c1CCNS(=O)(=O)c3ccco3 274078a_100000750322_200000702926 [0,1,0,0,0,0|1,1,0]=3 123 B23R3.40461 Cc1[nH]c2ccccc2c1CCNS(=O)(=O)c3cccs3 270084a_100000750322_100000205146 [0,1,0,0,0,0|1,0,0]=2 124 B23R3.40461 Cc1[nH]c2ccccc2c1CCNS(=O)(=O)c3cccs3 274078a_100000750322_100000205146 [0,1,0,0,0,0|1,0,0]=2 125 B23R3.40461 Cc1[nH]c2ccccc2c1CCNS(=O)(=O)c3cccs3 40a_100000750322_200000102146 [0,1,0,0,0,0|1,0,0]=2 126 B23R3.40461 Cc1[nH]c2ccccc2c1CCNS(=O)(=O)c3ccsc3 270084a_100000750322_100000756429 [0,1,0,0,0,0|3,0,0]=4 127 B23R3.40461 Cc1[nH]c2ccccc2c1CCNS(=O)(=O)c3ccsc3 274078a_100000750322_100000756429 [0,1,0,0,0,0|3,0,0]=4 128 B23R3.40461 Cc1nc2ccccc2n1CCNS(=O)(=O)c3cccs3 270084a_200000204690_100000205146 [0,1,0,0,0,0|2,0,1]=4 129 B23R3.40461 Cc1nc2ccccc2n1CCNS(=O)(=O)c3cccs3 274078a_200000204690_100000205146 [0,1,0,0,0,0|2,0,1]=4 130 B23R3.40461 Cc1nc2ccccc2n1CCNS(=O)(=O)c3cccs3 40a_200000204690_200000102146 [0,1,0,0,0,0|2,0,1]=4 131 B23R3.40461 O=C1Nc2ccccc2C1CCNS(=O)(=O)c3cccs3 270084a_100000737811_100000205146 [0,1,0,0,0,0|2,0,1]=4 132 B23R3.40461 O=C1Nc2ccccc2C1CCNS(=O)(=O)c3cccs3 274078a_100000737811_100000205146 [0,1,0,0,0,0|2,0,1]=4 133 B23R3.40461 O=c1[nH]c2ccccc2n1CCNS(=O)(=O)c3cccs3 270084a_203549771432_100000205146 [0,1,0,0,0,0|3,0,0]=4 134 B23R3.40461 O=c1[nH]c2ccccc2n1CCNS(=O)(=O)c3cccs3 274078a_203549771432_100000205146 [0,1,0,0,0,0|3,0,0]=4 135 B23R3.40461 O=c1[nH]c2ccccc2n1CCNS(=O)(=O)c3cccs3 40a_203549771432_200000102146 [0,1,0,0,0,0|3,0,0]=4 136 B23R3.40845 CC(=NNC(=O)c1cccs1)c2c(sc3c2cccc3)C 4a_100000184746_200000068469 [0,1,0,0,0,0|2,0,1]=4 137 B23R3.40845 Cc1[nH]c2ccccc2c1C(=O)CNC(C)c3cccs3 2230a_100000703493_100000182688 [0,1,0,0,0,0|1,0,2]=4 138 B23R3.79689 CCc1oc2ccccc2c1C=NNC(=O)c3cccs3 4a_100000184746_100000206028 [0,1,0,0,0,0|2,0,1]=4 139 B23R3.79689 CCc1sc2ccccc2c1C=NNC(=O)c3cccs3 4a_100000184746_100010627023 [0,1,0,0,0,0|2,0,1]=4 140 B23R3.729285 Cc1[nH]c2ccccc2c1CC(=O)CC(=O)c3ccc[nH]3 1458a_100000737320_200011262396 [0,1,0,0,0,0|2,0,1]=4 141 B23R3.729285 Cc1[nH]c2ccccc2c1CC(=O)CC(=O)c3ccco3 1458a_100000737320_100000211439 [0,1,0,0,0,0|1,1,1]=4 142 B23R3.729285 Cc1[nH]c2ccccc2c1CC(=O)CC(=O)c3cccs3 1458a_100000737320_100000211436 [0,1,0,0,0,0|1,0,1]=3 143 B23R3.729285 Cc1[nH]c2ccccc2c1CC(=O)CC(=O)c3nccs3 1458a_100000737320_100000718653 [0,1,0,0,0,0|2,0,1]=4 144 B23R3.729285 Cc1[nH]c2ccccc2c1CC(=O)NC(C)c3cccs3 11a_100000703493_100000737320 [0,1,0,0,0,0|1,0,2]=4 145 B23R3.729285 Cc1[nH]c2ccccc2c1CC(=O)NC(C)c3cccs3 240690a_100000703493_100000737320 [0,1,0,0,0,0|1,0,2]=4 146 B23R3.729285 Cc1[nH]c2ccccc2c1CC(=O)NC(C)c3cccs3 527a_100000703493_100000737320 [0,1,0,0,0,0|1,0,2]=4 147 B23R3.3070348 CCC(NCCc1c([nH]c2c1cccc2)C)c3ccc[nH]3 269862a_100000750322_200000242565 [0,1,0,0,0,0|2,0,1]=4 148 B23R3.3070348 CCC(NCCc1c([nH]c2c1cccc2)C)c3ccco3 269862a_100000750322_100000749595 [0,1,0,0,0,0|1,1,1]=4 149 B23R3.3070348 CCC(NCCc1c([nH]c2c1cccc2)C)c3cccs3 269862a_100000750322_100000211688 [0,1,0,0,0,0|1,0,1]=3 150 B23R3.3070348 CCC(NCCc1c([nH]c2c1cccc2)C)c3nccs3 269862a_100000750322_100000031915 [0,1,0,0,0,0|2,0,1]=4 151 B23R3.7695790 Cc1[nH]c2ccccc2c1C=NNC(=O)c3cc(c[nH]3)Br 4a_100000704317_100000186307 [0,1,0,0,0,0|2,0,1]=4 152 B23R3.7695790 Cc1[nH]c2ccccc2c1C=NNC(=O)c3ccc(o3)Br 4a_100000186364_100000186307 [0,1,0,0,0,0|1,1,1]=4 153 B23R3.7695790 Cc1[nH]c2ccccc2c1C=NNC(=O)c3ccc(s3)Br 4a_100000180196_100000186307 [0,1,0,0,0,0|1,0,1]=3 154 B23R3.7695790 Cc1[nH]c2ccccc2c1C=NNC(=O)c3ccc(s3)Cl 4a_100000189877_100000186307 [0,1,0,0,0,0|1,0,1]=3 155 B23R3.7695790 Cc1[nH]c2ccccc2c1CCNC(=O)C3=NNC(=O)C3 240690a_100000750322_200000752725 [0,1,0,0,0,0|2,0,1]=4 156 B23R3.7695790 Cc1[nH]c2ccccc2c1CCNC(=O)C3=NNC(=O)C3 527a_100000750322_200000752725 [0,1,0,0,0,0|2,0,1]=4 157 B23R3.7695790 Cc1[nH]c2ccccc2c1CCNC(C)c3cc(cs3)Br 269862a_100000750322_100000718618 [0,1,0,0,0,0|1,0,1]=3 158 B23R3.7695790 Cc1[nH]c2ccccc2c1CCNC(C)c3cc(cs3)Cl 269862a_100000750322_100000061699 [0,1,0,0,0,0|1,0,1]=3 159 B23R3.7695790 Cc1[nH]c2ccccc2c1CCNC(C)c3ccc([nH]3)Br 269862a_100000750322_200010494458 [0,1,0,0,0,0|2,0,1]=4 160 B23R3.7695790 Cc1[nH]c2ccccc2c1CCNC(C)c3ccc(s3)Br 269862a_100000750322_100000183331 [0,1,0,0,0,0|1,0,1]=3 161 B23R3.7695790 Cc1[nH]c2ccccc2c1CCNC(C)c3ccc(s3)Cl 269862a_100000750322_100000182421 [0,1,0,0,0,0|1,0,1]=3 162 B23R3.7695790 Cc1[nH]c2ccccc2c1CCNC(C)c3ccc(s3)I 269862a_100000750322_200000034408 [0,1,0,0,0,0|1,0,1]=3 163 B23R3.7695790 Cc1ccc(o1)C(=O)NN=Cc2c([nH]c3c2cccc3)C 4a_100000189940_100000186307 [0,1,0,0,0,0|1,1,1]=4 164 B23R3.7695790 Cc1ccc(o1)C(C)NCCc2c([nH]c3c2cccc3)C 269862a_100000750322_100000204583 [0,1,0,0,0,0|1,1,1]=4 165 B23R3.7695790 Cc1ccc(s1)C(=O)NN=Cc2c([nH]c3c2cccc3)Br 4a_100000189777_100010159312 [0,1,0,0,0,0|2,0,1]=4 166 B23R3.7695790 Cc1ccc(s1)C(=O)NN=Cc2c([nH]c3c2cccc3)C 4a_100000189777_100000186307 [0,1,0,0,0,0|1,0,1]=3 167 B23R3.7695790 Cc1ccc(s1)C(=O)NN=Cc2c([nH]c3c2cccc3)Cl 4a_100000189777_100000017700 [0,1,0,0,0,0|2,0,1]=4 168 B23R3.7695790 Cc1ccc(s1)C(=O)NN=Cc2c(sc3c2cccc3)C 4a_100000189777_100000066825 [0,1,0,0,0,0|2,0,1]=4 169 B23R3.7695790 Cc1ccc(s1)C(C)NCCc2c([nH]c3c2cccc3)C 269862a_100000750322_100000195387 [0,1,0,0,0,0|1,0,1]=3 170 B23R3.7695790 Cc1cnc(s1)C(C)NCCc2c([nH]c3c2cccc3)C 269862a_100000750322_100011857370 [0,1,0,0,0,0|2,0,1]=4 171 B23R3.7695790 Cc1csc(c1)C(=O)NN=Cc2c([nH]c3c2cccc3)Br 4a_100000143654_100010159312 [0,1,0,0,0,0|2,0,1]=4 172 B23R3.7695790 Cc1csc(c1)C(=O)NN=Cc2c([nH]c3c2cccc3)C 4a_100000143654_100000186307 [0,1,0,0,0,0|1,0,1]=3 173 B23R3.7695790 Cc1csc(c1)C(=O)NN=Cc2c([nH]c3c2cccc3)Cl 4a_100000143654_100000017700 [0,1,0,0,0,0|2,0,1]=4 174 B23R3.7695790 Cc1csc(c1)C(=O)NN=Cc2c(sc3c2cccc3)C 4a_100000143654_100000066825 [0,1,0,0,0,0|2,0,1]=4 175 B23R3.7695790 Cc1csc(c1)C(C)NCCc2c([nH]c3c2cccc3)C 269862a_100000750322_100000034720 [0,1,0,0,0,0|1,0,1]=3 176 B23R3.7695790 Cc1csc(n1)C(C)NCCc2c([nH]c3c2cccc3)C 269862a_100000750322_100011857357 [0,1,0,0,0,0|2,0,1]=4 177 B23R3.7695790 Cc1sc2ccccc2c1C=NNC(=O)c3ccc(s3)Br 4a_100000180196_100000066825 [0,1,0,0,0,0|2,0,1]=4 178 B23R3.7695790 Cc1sc2ccccc2c1C=NNC(=O)c3ccc(s3)Cl 4a_100000189877_100000066825 [0,1,0,0,0,0|2,0,1]=4 179 B23R3.7695790 O=C(NN=Cc1c([nH]c2c1cccc2)Br)c3ccc(s3)Br 4a_100000180196_100010159312 [0,1,0,0,0,0|2,0,1]=4 180 B23R3.7695790 O=C(NN=Cc1c([nH]c2c1cccc2)Br)c3ccc(s3)Cl 4a_100000189877_100010159312 [0,1,0,0,0,0|2,0,1]=4 181 B23R3.7695790 O=C(NN=Cc1c([nH]c2c1cccc2)Cl)c3ccc(s3)Br 4a_100000180196_100000017700 [0,1,0,0,0,0|2,0,1]=4 182 B23R3.7695790 O=C(NN=Cc1c([nH]c2c1cccc2)Cl)c3ccc(s3)Cl 4a_100000189877_100000017700 [0,1,0,0,0,0|2,0,1]=4 183 B23R3.7992025 Cc1[nH]c2ccc(cc2c1C=NNC(=O)c3ccc[nH]3)Cl 4a_100000018271_100000692368 [0,1,0,0,0,0|2,0,1]=4 184 B23R3.7992025 Cc1[nH]c2ccc(cc2c1C=NNC(=O)c3ccc[nH]3)F 4a_100000018271_100000244797 [0,1,0,0,0,0|2,0,1]=4 185 B23R3.7992025 Cc1[nH]c2ccc(cc2c1C=NNC(=O)c3ccco3)Cl 4a_100000185077_100000692368 [0,1,0,0,0,0|1,1,1]=4 186 B23R3.7992025 Cc1[nH]c2ccc(cc2c1C=NNC(=O)c3ccco3)F 4a_100000185077_100000244797 [0,1,0,0,0,0|1,1,1]=4 187 B23R3.7992025 Cc1[nH]c2ccc(cc2c1C=NNC(=O)c3cccs3)Cl 4a_100000184746_100000692368 [0,1,0,0,0,0|1,0,1]=3 188 B23R3.7992025 Cc1[nH]c2ccc(cc2c1C=NNC(=O)c3cccs3)F 4a_100000184746_100000244797 [0,1,0,0,0,0|1,0,1]=3 189 B23R3.7992025 Cc1[nH]c2ccc(cc2c1C=NNC(=O)c3cncs3)Cl 4a_200000241815_100000692368 [0,1,0,0,0,0|2,0,1]=4 190 B23R3.7992025 Cc1[nH]c2ccc(cc2c1C=NNC(=O)c3cncs3)F 4a_200000241815_100000244797 [0,1,0,0,0,0|2,0,1]=4 191 B23R3.7992025 Cc1[nH]c2ccc(cc2c1C=NNC(=O)c3nccs3)Cl 4a_100000077877_100000692368 [0,1,0,0,0,0|2,0,1]=4 192 B23R3.7992025 Cc1[nH]c2ccc(cc2c1C=NNC(=O)c3nccs3)F 4a_100000077877_100000244797 [0,1,0,0,0,0|2,0,1]=4 193 B23R3.7992025 Cc1[nH]c2ccc(cc2c1CCNC(=O)C3=CCCC3)F 11a_100015200695_100000038896 [0,1,0,0,0,0|1,0,2]=4 194 B23R3.7992025 Cc1[nH]c2ccc(cc2c1CCNC(=O)C3=CCCC3)F 240690a_100015200695_100000038896 [0,1,0,0,0,0|1,0,2]=4 195 B23R3.7992025 Cc1[nH]c2ccc(cc2c1CCNC(=O)C3=CCOC3)F 11a_100015200695_100000139269 [0,1,0,0,0,0|2,0,1]=4 196 B23R3.7992025 Cc1[nH]c2ccc(cc2c1CCNC(=O)C3=CCOC3)F 240690a_100015200695_100000139269 [0,1,0,0,0,0|2,0,1]=4 197 B23R3.7992025 Cc1[nH]c2ccc(cc2c1CCNC(=O)C3=COCC3)F 240690a_100015200695_100000750620 [0,1,0,0,0,0|2,0,1]=4 198 B23R3.7992025 Cc1[nH]c2ccc(cc2c1CCNC(=O)C3CC=CC3)F 11a_100015200695_100000759439 [0,1,0,0,0,0|1,0,2]=4 199 B23R3.7992025 Cc1[nH]c2ccc(cc2c1CCNC(=O)C3CC=CC3)F 240690a_100015200695_100000759439 [0,1,0,0,0,0|1,0,2]=4 200 B23R3.7992025 Cc1[nH]c2ccc(cc2c1CCNC(=O)C3CC=CC3)F 527a_100015200695_100000759439 [0,1,0,0,0,0|1,0,2]=4 201 B23R3.7992025 Cc1[nH]c2ccc(cc2c1CCNC(=O)N3CC=CC3)F 2708a_100015200695_100015195280 [0,1,0,0,0,0|2,0,1]=4 202 B23R3.7992025 Cc1[nH]c2ccc(cc2c1CCNC(=O)N3CC=CC3)F 273464a_100015200695_100015195280 [0,1,0,0,0,0|2,0,1]=4 203 B23R3.7992025 Cc1[nH]c2ccc(cc2c1CCNC(C)c3ccc[nH]3)F 269862a_100015200695_100000183661 [0,1,0,0,0,0|2,0,1]=4 204 B23R3.7992025 Cc1[nH]c2ccc(cc2c1CCNC(C)c3cccs3)F 269862a_100015200695_100000185736 [0,1,0,0,0,0|1,0,1]=3 205 B23R3.7992025 Cc1ccc2[nH]c(c(c2c1)CCNC(=O)C3=CCCC3)C 11a_100000076026_100000038896 [0,1,0,0,0,0|1,0,2]=4 206 B23R3.7992025 Cc1ccc2[nH]c(c(c2c1)CCNC(=O)C3=CCCC3)C 240690a_100000076026_100000038896 [0,1,0,0,0,0|1,0,2]=4 207 B23R3.7992025 Cc1ccc2[nH]c(c(c2c1)CCNC(=O)C3=CCOC3)C 11a_100000076026_100000139269 [0,1,0,0,0,0|2,0,1]=4 208 B23R3.7992025 Cc1ccc2[nH]c(c(c2c1)CCNC(=O)C3=CCOC3)C 240690a_100000076026_100000139269 [0,1,0,0,0,0|2,0,1]=4 209 B23R3.7992025 Cc1ccc2[nH]c(c(c2c1)CCNC(=O)C3=COCC3)C 240690a_100000076026_100000750620 [0,1,0,0,0,0|2,0,1]=4 210 B23R3.7992025 Cc1ccc2[nH]c(c(c2c1)CCNC(=O)C3CC=CC3)C 11a_100000076026_100000759439 [0,1,0,0,0,0|1,0,2]=4 211 B23R3.7992025 Cc1ccc2[nH]c(c(c2c1)CCNC(=O)C3CC=CC3)C 240690a_100000076026_100000759439 [0,1,0,0,0,0|1,0,2]=4 212 B23R3.7992025 Cc1ccc2[nH]c(c(c2c1)CCNC(=O)C3CC=CC3)C 527a_100000076026_100000759439 [0,1,0,0,0,0|1,0,2]=4 213 B23R3.7992025 Cc1ccc2[nH]c(c(c2c1)CCNC(=O)N3CC=CC3)C 2708a_100000076026_100015195280 [0,1,0,0,0,0|2,0,1]=4 214 B23R3.7992025 Cc1ccc2[nH]c(c(c2c1)CCNC(=O)N3CC=CC3)C 273464a_100000076026_100015195280 [0,1,0,0,0,0|2,0,1]=4 215 B23R3.7992025 Cc1ccc2[nH]c(c(c2c1)CCNC(C)c3ccc[nH]3)C 269862a_100000076026_100000183661 [0,1,0,0,0,0|2,0,1]=4 216 B23R3.7992025 Cc1ccc2[nH]c(c(c2c1)CCNC(C)c3cccs3)C 269862a_100000076026_100000185736 [0,1,0,0,0,0|1,0,1]=3 217 B23R3.9667003 Cc1[nH]c2ccccc2c1C=NNC(=O)c3cccn3C 4a_100000189942_100000186307 [0,1,0,0,0,0|2,0,1]=4 218 B23R3.9667003 Cc1[nH]c2ccccc2c1C=NNC(=O)c3sccc3Cl 4a_100012021866_100000186307 [0,1,0,0,0,0|1,0,1]=3 219 B23R3.9667003 Cc1[nH]c2ccccc2c1CCNC(C)c3cccn3C 269862a_100000750322_100000709046 [0,1,0,0,0,0|2,0,1]=4 220 B23R3.9667003 Cc1[nH]c2ccccc2c1CCNC(C)c3sccc3Br 269862a_100000750322_100000738688 [0,1,0,0,0,0|1,0,1]=3 221 B23R3.9667003 Cc1ccsc1C(=O)NN=Cc2c([nH]c3c2cccc3)Br 4a_100000189776_100010159312 [0,1,0,0,0,0|2,0,1]=4 222 B23R3.9667003 Cc1ccsc1C(=O)NN=Cc2c([nH]c3c2cccc3)C 4a_100000189776_100000186307 [0,1,0,0,0,0|1,0,1]=3 223 B23R3.9667003 Cc1ccsc1C(=O)NN=Cc2c([nH]c3c2cccc3)Cl 4a_100000189776_100000017700 [0,1,0,0,0,0|2,0,1]=4 224 B23R3.9667003 Cc1ccsc1C(=O)NN=Cc2c(sc3c2cccc3)C 4a_100000189776_100000066825 [0,1,0,0,0,0|2,0,1]=4 225 B23R3.9667003 Cc1sc2ccccc2c1C=NNC(=O)c3sccc3Cl 4a_100012021866_100000066825 [0,1,0,0,0,0|2,0,1]=4 226 B23R3.9667003 O=C(NN=Cc1c([nH]c2c1cccc2)Br)c3sccc3Cl 4a_100012021866_100010159312 [0,1,0,0,0,0|2,0,1]=4 227 B23R3.9667003 O=C(NN=Cc1c([nH]c2c1cccc2)Cl)c3sccc3Cl 4a_100012021866_100000017700 [0,1,0,0,0,0|2,0,1]=4 228 B23R3.15982071 Cc1[nH]c2c(cccc2c1C=NNC(=O)c3ccc[nH]3)C 4a_100000018271_200011934716 [0,1,0,0,0,0|2,0,1]=4 229 B23R3.15982071 Cc1[nH]c2c(cccc2c1C=NNC(=O)c3ccco3)C 4a_100000185077_200011934716 [0,1,0,0,0,0|1,1,1]=4 230 B23R3.15982071 Cc1[nH]c2c(cccc2c1C=NNC(=O)c3cccs3)C 4a_100000184746_200011934716 [0,1,0,0,0,0|1,0,1]=3 231 B23R3.15982071 Cc1[nH]c2c(cccc2c1C=NNC(=O)c3cncs3)C 4a_200000241815_200011934716 [0,1,0,0,0,0|2,0,1]=4 232 B23R3.15982071 Cc1[nH]c2c(cccc2c1C=NNC(=O)c3nccs3)C 4a_100000077877_200011934716 [0,1,0,0,0,0|2,0,1]=4 233 B23R3.34382532 Cc1c(c2ccccc2n1C)C=NNC(=O)c3ccc[nH]3 4a_100000018271_100000009060 [0,1,0,0,0,0|2,0,1]=4 234 B23R3.34382532 Cc1c(c2ccccc2n1C)C=NNC(=O)c3ccco3 4a_100000185077_100000009060 [0,1,0,0,0,0|1,1,1]=4 235 B23R3.34382532 Cc1c(c2ccccc2n1C)C=NNC(=O)c3cccs3 4a_100000184746_100000009060 [0,1,0,0,0,0|1,0,1]=3 236 B23R3.34382532 Cc1c(c2ccccc2n1C)C=NNC(=O)c3cncs3 4a_200000241815_100000009060 [0,1,0,0,0,0|2,0,1]=4 237 B23R3.34382532 Cc1c(c2ccccc2n1C)C=NNC(=O)c3nccs3 4a_100000077877_100000009060 [0,1,0,0,0,0|2,0,1]=4 238 B23R3.34382532 Cn1c(c(c2c1cccc2)C=NNC(=O)c3cccs3)Cl 4a_100000184746_100000018933 [0,1,0,0,0,0|2,0,1]=4 239 B21R2.258006 O=C(CCCNC(=O)c1ccco1)Nc2ccccc2 11a_100000106764_100000194748 [0,0,1,0,0,0|1,1,1]=4 240 B21R2.258006 O=C(CCCNC(=O)c1ccco1)Nc2ccccc2 1626a_100000106764_100000194748 [0,0,1,0,0,0|1,1,1]=4 241 B21R2.258006 O=C(CCCNC(=O)c1ccco1)Nc2ccccc2 22a_100000106764_100000194748 [0,0,1,0,0,0|1,1,1]=4 242 B21R2.258006 O=C(CCCNC(=O)c1ccco1)Nc2ccccc2 527a_100000106764_100000194748 [0,0,1,0,0,0|1,1,1]=4 243 B21R2.258006 O=C(CCCNC(=O)c1cccs1)Cc2ccccc2 1458a_100000194764_100015291786 [0,0,1,0,0,0|2,0,1]=4 244 B21R2.258006 O=C(CCCNC(=O)c1cccs1)Nc2ccccc2 11a_100000106764_100000194764 [0,0,1,0,0,0|1,0,1]=3 245 B21R2.258006 O=C(CCCNC(=O)c1cccs1)Nc2ccccc2 1626a_100000106764_100000194764 [0,0,1,0,0,0|1,0,1]=3 246 B21R2.258006 O=C(CCCNC(=O)c1cccs1)Nc2ccccc2 22a_100000106764_100000194764 [0,0,1,0,0,0|1,0,1]=3 247 B21R2.258006 O=C(CCCNC(=O)c1cccs1)Nc2ccccc2 527a_100000106764_100000194764 [0,0,1,0,0,0|1,0,1]=3 248 B21R2.515147 C/C=C/C=CC(=O)NCCC1C(=O)Nc2c1cccc2 240690a_100000737811_100000185730 [0,0,1,0,0,0|2,0,1]=4 249 B21R2.515147 C/C=C/C=CC(=O)NCCc1c([nH]c2c1cccc2)C 240690a_100000750322_100000185730 [0,0,1,0,0,0|1,0,0]=2 250 B21R2.515147 C/C=C/C=CC(=O)NCCn1c(=O)[nH]c2c1cccc2 11a_203549771432_100000185730 [0,0,1,0,0,0|3,0,0]=4 251 B21R2.515147 C/C=C/C=CC(=O)NCCn1c(=O)[nH]c2c1cccc2 240690a_203549771432_100000185730 [0,0,1,0,0,0|3,0,0]=4 252 B21R2.515147 C/C=C/C=CC(=O)NCCn1c(nc2c1cccc2)C 11a_200000204690_100000185730 [0,0,1,0,0,0|2,0,1]=4 253 B21R2.515147 C/C=C/C=CC(=O)NCCn1c(nc2c1cccc2)C 1626a_200000204690_100000185730 [0,0,1,0,0,0|2,0,1]=4 254 B21R2.515147 C/C=C/C=CC(=O)NCCn1c(nc2c1cccc2)C 240690a_200000204690_100000185730 [0,0,1,0,0,0|2,0,1]=4 255 B21R2.515147 C=CCCCC(=O)NCCc1c([nH]c2c1cccc2)C 240690a_100000750322_100000766728 [0,0,1,0,0,0|1,0,2]=4 256 B21R2.515147 C=CCCCC(=O)NCCc1c([nH]c2c1cccc2)C 527a_100000750322_100000766728 [0,0,1,0,0,0|1,0,2]=4 257 B21R2.515147 C=CCCNC(=O)NCCc1c([nH]c2c1cccc2)C 2708a_100000750322_100015191253 [0,0,1,0,0,0|2,0,1]=4 258 B21R2.515147 C=CCCNC(=O)NCCc1c([nH]c2c1cccc2)C 2708a_100015191253_100000750322 [0,0,1,0,0,0|2,0,1]=4 259 B21R2.515147 C=CCCNC(=O)NCCc1c([nH]c2c1cccc2)C 273464a_100000750322_100015191253 [0,0,1,0,0,0|2,0,1]=4 260 B21R2.515147 C=CCCNC(=O)NCCc1c([nH]c2c1cccc2)C 273464a_100015191253_100000750322 [0,0,1,0,0,0|2,0,1]=4 261 B21R2.515147 C=CCCNC(=O)NCCc1c([nH]c2c1cccc2)C 512a_100000750322_100015191253 [0,0,1,0,0,0|2,0,1]=4 262 B21R2.515147 C=CCCNC(=O)NCCc1c([nH]c2c1cccc2)C 512a_100015191253_100000750322 [0,0,1,0,0,0|2,0,1]=4 263 B21R2.515147 C=CCNNC(=O)NCCc1c([nH]c2c1cccc2)C 273464a_100000750322_100020588587 [0,0,1,0,0,0|2,0,1]=4 264 B21R2.515147 C=CCNNC(=O)NCCc1c([nH]c2c1cccc2)C 512a_100000750322_100020588587 [0,0,1,0,0,0|2,0,1]=4 265 B21R2.515147 C=CCNNC(=O)NCCc1c([nH]c2c1cccc2)C 512a_100020588587_100000750322 [0,0,1,0,0,0|2,0,1]=4 266 B21R2.515147 C=CCSCC(=O)NCCc1c([nH]c2c1cccc2)C 240690a_100000750322_100000230395 [0,0,1,0,0,0|0,0,2]=3 267 B21R2.515147 C=CCSCC(=O)NCCc1c([nH]c2c1cccc2)C 527a_100000750322_100000230395 [0,0,1,0,0,0|0,0,2]=3 268 B21R2.515147 CC/C=C/CC(=O)NCCc1c([nH]c2c1cccc2)C 240690a_100000750322_100016274230 [0,0,1,0,0,0|1,0,2]=4 269 B21R2.515147 CC/C=C/CC(=O)NCCc1c([nH]c2c1cccc2)C 527a_100000750322_100016274230 [0,0,1,0,0,0|1,0,2]=4 270 B21R2.515147 CCCC=CC(=O)NCCc1c([nH]c2c1cccc2)C 240690a_100000750322_100000212230 [0,0,1,0,0,0|1,0,2]=4 271 B21R2.515147 CCOC=CC(=O)NCCc1c([nH]c2c1cccc2)C 240690a_100000750322_100016266692 [0,0,1,0,0,0|2,0,1]=4 272 B21R2.515147 COCC=CC(=O)NCCc1c([nH]c2c1cccc2)C 240690a_100000750322_100016285016 [0,0,1,0,0,0|2,0,1]=4 273 B21R2.5401286 C=CCC(C)C(=O)NCCc1c([nH]c2c1cccc2)C 240690a_100000750322_100011216819 [0,0,1,0,0,0|1,0,2]=4 274 B21R2.5401286 C=CCC(C)C(=O)NCCc1c([nH]c2c1cccc2)C 527a_100000750322_100011216819 [0,0,1,0,0,0|1,0,2]=4 275 B21R2.5401286 C=CCN(C)C(=O)NCCc1c([nH]c2c1cccc2)C 2708a_100000750322_100000225617 [0,0,1,0,0,0|2,0,1]=4 276 B21R2.5401286 C=CCN(C)C(=O)NCCc1c([nH]c2c1cccc2)C 273464a_100000750322_100000225617 [0,0,1,0,0,0|2,0,1]=4 277 B21R2.5401286 CC/C=C(\C)/C(=O)NCCc1c([nH]c2c1cccc2)C 240690a_100000750322_100016988807 [0,0,1,0,0,0|1,0,2]=4 278 B21R2.5401286 CC/C=C(\C)/C(=O)NCCc1c([nH]c2c1cccc2)C 527a_100000750322_100016988807 [0,0,1,0,0,0|1,0,2]=4 279 B23R4.3677401 O=C(C1=CCCC1)N2CCc3c([nH]c4c3cccc4)C2 11a_100000694026_100000038896 [0,0,0,1,0,0|1,0,2]=4 280 B23R4.3677401 O=C(C1=CCCC1)N2CCc3c([nH]c4c3cccc4)C2 240690a_100000694026_100000038896 [0,0,0,1,0,0|1,0,2]=4 281 B23R4.3677401 O=C(C1=CCOC1)N2CCc3c([nH]c4c3cccc4)C2 11a_100000694026_100000139269 [0,0,0,1,0,0|2,0,1]=4 282 B23R4.3677401 O=C(C1=CCOC1)N2CCc3c([nH]c4c3cccc4)C2 240690a_100000694026_100000139269 [0,0,0,1,0,0|2,0,1]=4 283 B23R4.3677401 O=C(C1=COCC1)N2CCc3c([nH]c4c3cccc4)C2 240690a_100000694026_100000750620 [0,0,0,1,0,0|2,0,1]=4 284 B23R4.3677401 O=C(C1CC=CC1)N2CCc3c([nH]c4c3cccc4)C2 11a_100000694026_100000759439 [0,0,0,1,0,0|1,0,2]=4 285 B23R4.3677401 O=C(C1CC=CC1)N2CCc3c([nH]c4c3cccc4)C2 240690a_100000694026_100000759439 [0,0,0,1,0,0|1,0,2]=4 286 B23R4.3677401 O=C(C1CC=CC1)N2CCc3c([nH]c4c3cccc4)C2 527a_100000694026_100000759439 [0,0,0,1,0,0|1,0,2]=4 287 B23R4.26386878 CC(NC1Cc2[nH]c3ccccc3c2C1)c4ccc[nH]4 269862a_100009852730_100000183661 [0,0,0,1,0,0|2,0,1]=4 288 B23R4.26386878 CC(NC1Cc2[nH]c3ccccc3c2C1)c4cccs4 269862a_100009852730_100000185736 [0,0,0,1,0,0|1,0,1]=3 289 B23R4.26386878 O=C(NC1Cc2[nH]c3ccccc3c2C1)C4=CCCC4 1626a_100009852730_100000038896 [0,0,0,1,0,0|1,0,2]=4 290 B23R4.26386878 O=C(NC1Cc2[nH]c3ccccc3c2C1)C4=CCCC4 240690a_100009852730_100000038896 [0,0,0,1,0,0|1,0,2]=4 291 B23R4.26386878 O=C(NC1Cc2[nH]c3ccccc3c2C1)C4=CCOC4 1626a_100009852730_100000139269 [0,0,0,1,0,0|2,0,1]=4 292 B23R4.26386878 O=C(NC1Cc2[nH]c3ccccc3c2C1)C4=CCOC4 240690a_100009852730_100000139269 [0,0,0,1,0,0|2,0,1]=4 293 B23R4.26386878 O=C(NC1Cc2[nH]c3ccccc3c2C1)C4=COCC4 1626a_100009852730_100000750620 [0,0,0,1,0,0|2,0,1]=4 294 B23R4.26386878 O=C(NC1Cc2[nH]c3ccccc3c2C1)C4=COCC4 240690a_100009852730_100000750620 [0,0,0,1,0,0|2,0,1]=4 295 B23R4.26386878 O=C(NC1Cc2[nH]c3ccccc3c2C1)C4CC=CC4 1626a_100009852730_100000759439 [0,0,0,1,0,0|1,0,2]=4 296 B23R4.26386878 O=C(NC1Cc2[nH]c3ccccc3c2C1)C4CC=CC4 240690a_100009852730_100000759439 [0,0,0,1,0,0|1,0,2]=4 297 B23R4.26386878 O=C(NC1Cc2[nH]c3ccccc3c2C1)C4CC=CC4 527a_100009852730_100000759439 [0,0,0,1,0,0|1,0,2]=4 298 B23R4.26386878 O=C(NC1Cc2[nH]c3ccccc3c2C1)N4CC=CC4 2708a_100009852730_100015195280 [0,0,0,1,0,0|2,0,1]=4 299 B21R3.19585 CC1Cc2ccccc2C1=NNC(=O)c3cccs3 4a_100000184746_100000684640 [0,0,0,0,1,0|2,0,1]=4 300 B21R3.19585 Cc1[nH]c2ncccc2c1SCC(=O)c3ccc[nH]3 62a_200011262396_100010174266 [0,0,0,0,1,0|3,0,0]=4 301 B21R3.19585 Cc1[nH]c2ncccc2c1SCC(=O)c3ccco3 62a_100000211439_100010174266 [0,0,0,0,1,0|2,1,0]=4 302 B21R3.19585 Cc1[nH]c2ncccc2c1SCC(=O)c3cccs3 62a_100000211436_100010174266 [0,0,0,0,1,0|2,0,0]=3 303 B21R3.19585 Cc1[nH]c2ncccc2c1SCC(=O)c3nccs3 62a_100000718653_100010174266 [0,0,0,0,1,0|3,0,0]=4 304 B21R3.19585 Cc1nc2ccccn2c1SCC(=O)c3cccs3 62a_100000211436_100000762796 [0,0,0,0,1,0|2,0,1]=4 305 B21R3.19585 Cc1nc2ccccn2c1SCC(=O)c3cccs3 62a_100000762796_100000211436 [0,0,0,0,1,0|2,0,1]=4 306 B21R3.19585 Cc1oc2ccccc2c1SCC(=O)c3ccc[nH]3 62a_200011262396_200010236113 [0,0,0,0,1,0|3,0,0]=4 307 B21R3.19585 Cc1oc2ccccc2c1SCC(=O)c3ccco3 62a_100000211439_200010236113 [0,0,0,0,1,0|2,1,0]=4 308 B21R3.19585 Cc1oc2ccccc2c1SCC(=O)c3cccs3 62a_100000211436_200010236113 [0,0,0,0,1,0|2,0,0]=3 309 B21R3.19585 Cc1oc2ccccc2c1SCC(=O)c3nccs3 62a_100000718653_200010236113 [0,0,0,0,1,0|3,0,0]=4 310 B21R3.19585 Cc1sc2ccccc2c1CNC(C)c3cccs3 207a_100000703493_100000066825 [0,0,0,0,1,0|2,0,1]=4 311 B21R3.19585 Cc1sc2ccccc2c1CNC(C)c3cccs3 270004a_100000703493_100000066825 [0,0,0,0,1,0|2,0,1]=4 312 B21R3.19585 Cc1sc2ccccc2c1SCC(=O)c3ccc[nH]3 62a_100010002616_200011262396 [0,0,0,0,1,0|3,0,0]=4 313 B21R3.19585 Cc1sc2ccccc2c1SCC(=O)c3ccc[nH]3 62a_200011262396_100010002616 [0,0,0,0,1,0|3,0,0]=4 314 B21R3.19585 Cc1sc2ccccc2c1SCC(=O)c3ccco3 62a_100000211439_100010002616 [0,0,0,0,1,0|2,1,0]=4 315 B21R3.19585 Cc1sc2ccccc2c1SCC(=O)c3ccco3 62a_100010002616_100000211439 [0,0,0,0,1,0|2,1,0]=4 316 B21R3.19585 Cc1sc2ccccc2c1SCC(=O)c3cccs3 62a_100000211436_100010002616 [0,0,0,0,1,0|2,0,0]=3 317 B21R3.19585 Cc1sc2ccccc2c1SCC(=O)c3cccs3 62a_100010002616_100000211436 [0,0,0,0,1,0|2,0,0]=3 318 B21R3.19585 Cc1sc2ccccc2c1SCC(=O)c3nccs3 62a_100000718653_100010002616 [0,0,0,0,1,0|3,0,0]=4 319 B21R3.19585 Cc1sc2ccccc2c1SCC(=O)c3nccs3 62a_100010002616_100000718653 [0,0,0,0,1,0|3,0,0]=4 320 B21R3.19585 Cn1nc2ccccc2c1SCC(=O)c3cccs3 62a_100000211436_100010163699 [0,0,0,0,1,0|2,0,1]=4 321 B21R3.19585 Cn1nc2ccccc2c1SCC(=O)c3cccs3 62a_100010163699_100000211436 [0,0,0,0,1,0|2,0,1]=4 322 B21R3.19585 O=C(CSC1C(=O)Nc2c1cccc2)c3cccs3 62a_100000211436_200009996675 [0,0,0,0,1,0|2,0,1]=4 323 B21R3.19585 O=C1Nc2ccccc2C1=NNC(=O)c3ccc[nH]3 4a_100000018271_100000185742 [0,0,0,0,1,0|3,0,0]=4 324 B21R3.19585 O=C1Nc2ccccc2C1=NNC(=O)c3ccco3 4a_100000185077_100000185742 [0,0,0,0,1,0|2,1,0]=4 325 B21R3.19585 O=C1Nc2ccccc2C1=NNC(=O)c3cccs3 4a_100000184746_100000185742 [0,0,0,0,1,0|2,0,0]=3 326 B21R3.19585 O=C1Nc2ccccc2C1=NNC(=O)c3cncs3 4a_200000241815_100000185742 [0,0,0,0,1,0|3,0,0]=4 327 B21R3.19585 O=C1Nc2ccccc2C1=NNC(=O)c3nccs3 4a_100000077877_100000185742 [0,0,0,0,1,0|3,0,0]=4 328 B21R3.19585 O=C1Nc2ncccc2C1=NNC(=O)c3cccs3 4a_100000184746_100000098433 [0,0,0,0,1,0|3,0,0]=4 329 B21R3.19585 O=C1Sc2ccccc2C1=NNC(=O)c3cccs3 4a_100000184746_100011996146 [0,0,0,0,1,0|3,0,0]=4 330 B23R3.40533 Cc1cc2ccccc2cc1OCCC(=O)c3cccs3 7a_100000091601_100011290775 [0,0,0,0,0,1|3,0,0]=4 331 B23R3.40533 Cc1cc2ccccc2nc1SCCC(=O)c3cccs3 62a_100011290775_100000751756 [0,0,0,0,0,1|3,0,0]=4 332 B23R3.40533 Cc1nc2ccccc2cc1OCCC(=O)c3cccs3 7a_200000079175_100011290775 [0,0,0,0,0,1|2,0,1]=4 333 B23R3.40533 Cc1nc2ccccc2nc1C=NNC(=O)c3cccs3 4a_100000184746_100000013746 [0,0,0,0,0,1|1,0,2]=4 334 B23R3.40533 Cc1nc2ccccc2nc1SCCC(=O)c3cccs3 62a_100000757254_100011290775 [0,0,0,0,0,1|2,0,1]=4 335 B23R3.40533 Cc1nc2ccccc2nc1SCCC(=O)c3cccs3 62a_100011290775_100000185947 [0,0,0,0,0,1|2,0,1]=4 336 B23R3.40533 O=C(CSCc1nc2ccccc2[nH]c1=O)c3cccs3 62a_100000736137_100000211436 [0,0,0,0,0,1|3,0,0]=4 337 B23R3.40711 Cc1cc(c2ccccc2n1)C=NNC(=O)c3cccs3 4a_100000184746_100000752230 [0,0,0,0,0,1|1,0,2]=4 338 B23R3.40711 Cc1cc(c2ccccc2n1)CSCC(=O)c3cccs3 62a_100000211436_100000755639 [0,0,0,0,0,1|2,0,1]=4 339 B23R3.40711 Cc1cc(c2ccccc2n1)CSCC(=O)c3cccs3 62a_100000755639_100000211436 [0,0,0,0,0,1|2,0,1]=4 340 B23R3.40711 Cc1cc(c2ccccc2n1)SCCC(=O)c3cccs3 62a_100000764982_100011290775 [0,0,0,0,0,1|2,0,1]=4 341 B23R3.40711 Cc1cc(c2ccccc2n1)SCCC(=O)c3cccs3 62a_100011290775_100000735862 [0,0,0,0,0,1|2,0,1]=4 342 B23R3.40711 Cc1cc2ccccc2c(n1)SCCC(=O)c3cccs3 62a_100011290775_100000698243 [0,0,0,0,0,1|3,0,0]=4 343 B23R3.40711 Cc1nc(c2ccccc2n1)SCCC(=O)c3cccs3 62a_100000230251_100011290775 [0,0,0,0,0,1|2,0,1]=4 344 B23R3.40711 Cc1nc(c2ccccc2n1)SCCC(=O)c3cccs3 62a_100011290775_100000230251 [0,0,0,0,0,1|2,0,1]=4 345 B23R3.40711 O=C(CCSc1cc(=O)[nH]c2c1cccc2)c3cccs3 62a_100011290775_100000075698 [0,0,0,0,0,1|3,0,0]=4 346 B23R3.40833 Cc1[nH]c2ccccc2c1C=NNC(=O)c3ccccc3 4a_100000184135_100000186307 [0,0,0,0,0,1|2,0,1]=4 347 B23R3.40833 Cc1[nH]c2ccccc2c1C=NNC(=O)c3ccccn3 4a_100000184044_100000186307 [0,0,0,0,0,1|2,0,1]=4 348 B23R3.40833 Cc1[nH]c2ccccc2c1C=NNC(=O)c3cccnc3 4a_100000189771_100000186307 [0,0,0,0,0,1|2,0,1]=4 349 B23R3.40833 Cc1[nH]c2ccccc2c1C=NNC(=O)c3ccncc3 4a_100000189768_100000186307 [0,0,0,0,0,1|2,0,1]=4 350 B23R3.40833 Cc1[nH]c2ccccc2c1C=NNC(=O)c3ccncn3 4a_100000084330_100000186307 [0,0,0,0,0,1|2,0,1]=4 351 B23R3.40833 Cc1[nH]c2ccccc2c1C=NNC(=O)c3cnccn3 4a_100000189795_100000186307 [0,0,0,0,0,1|2,0,1]=4 352 B23R3.40833 Cc1[nH]c2ccccc2c1CCNC(=O)C3=CCCCC3 240690a_100000750322_100000765259 [0,0,0,0,0,1|1,0,2]=4 353 B23R3.40833 Cc1[nH]c2ccccc2c1CCNC(=O)C3=CCCCC3 527a_100000750322_100000765259 [0,0,0,0,0,1|1,0,2]=4 354 B23R3.40833 Cc1[nH]c2ccccc2c1CCNC(=O)C3=CCCCO3 240690a_100000750322_100000764163 [0,0,0,0,0,1|0,1,2]=4 355 B23R3.40833 Cc1[nH]c2ccccc2c1CCNC(=O)C3=CCCCO3 527a_100000750322_100000764163 [0,0,0,0,0,1|0,1,2]=4 356 B23R3.40833 Cc1[nH]c2ccccc2c1CCNC(=O)C3=COCCC3 527a_100000750322_100000749935 [0,0,0,0,0,1|1,0,2]=4 357 B23R3.40833 Cc1[nH]c2ccccc2c1CCNC(=O)C3=COCCO3 240690a_100000750322_100000008702 [0,0,0,0,0,1|0,1,2]=4 358 B23R3.40833 Cc1[nH]c2ccccc2c1CCNC(=O)C3=COCCO3 527a_100000750322_100000008702 [0,0,0,0,0,1|0,1,2]=4 359 B23R3.40833 Cc1[nH]c2ccccc2c1CCNC(=O)N3CC=CCC3 2708a_100000750322_100000698166 [0,0,0,0,0,1|2,0,1]=4 360 B23R3.40833 Cc1[nH]c2ccccc2c1CCNC(=O)N3CC=CCC3 273464a_100000750322_100000698166 [0,0,0,0,0,1|2,0,1]=4 361 B23R3.40833 Cc1[nH]c2ccccc2c1CCNC(=O)[C@H]3CC=CCC3 240690a_100000750322_100009820709 [0,0,0,0,0,1|1,0,2]=4 362 B23R3.40833 Cc1[nH]c2ccccc2c1CCNC(=O)[C@H]3CC=CCC3 527a_100000750322_100009820709 [0,0,0,0,0,1|1,0,2]=4 363 B23R3.40833 Cc1[nH]c2ccccc2c1CCNC(=O)c3ccccc3 240690a_100000750322_100000185807 [0,0,0,0,0,1|1,0,0]=2 364 B23R3.40833 Cc1[nH]c2ccccc2c1CCNC(=O)c3ccccc3 527a_100000750322_100000185807 [0,0,0,0,0,1|1,0,0]=2 365 B23R3.40833 Cc1[nH]c2ccccc2c1CCNC(C)c3ccccc3 269862a_100000750322_100000185851 [0,0,0,0,0,1|2,0,1]=4 366 B23R3.40833 Cc1[nH]c2ccccc2c1CCNC(C)c3ccccn3 269862a_100000750322_100000210467 [0,0,0,0,0,1|2,0,1]=4 367 B23R3.40833 Cc1[nH]c2ccccc2c1CCNC(C)c3cccnc3 269862a_100000750322_100000210468 [0,0,0,0,0,1|2,0,1]=4 368 B23R3.40833 Cc1[nH]c2ccccc2c1CCNC(C)c3cccnn3 269862a_100000750322_100009866853 [0,0,0,0,0,1|2,0,1]=4 369 B23R3.40833 Cc1[nH]c2ccccc2c1CCNC(C)c3ccncc3 269862a_100000750322_100000185792 [0,0,0,0,0,1|2,0,1]=4 370 B23R3.40833 Cc1[nH]c2ccccc2c1CCNC(C)c3cnccn3 269862a_100000750322_100000751083 [0,0,0,0,0,1|2,0,1]=4 371 B23R3.40833 Cc1[nH]c2ccccc2c1CCNC(C)c3ncccn3 270004a_100000750322_100011350828 [0,0,0,0,0,1|2,0,1]=4 372 B23R3.40833 Cc1nc2ccccc2n1CCNC(=O)c3ccccc3 11a_200000204690_100000185807 [0,0,0,0,0,1|2,0,1]=4 373 B23R3.40833 Cc1nc2ccccc2n1CCNC(=O)c3ccccc3 1626a_200000204690_100000185807 [0,0,0,0,0,1|2,0,1]=4 374 B23R3.40833 Cc1nc2ccccc2n1CCNC(=O)c3ccccc3 240690a_200000204690_100000185807 [0,0,0,0,0,1|2,0,1]=4 375 B23R3.40833 Cc1nc2ccccc2n1CCNC(=O)c3ccccc3 527a_200000204690_100000185807 [0,0,0,0,0,1|2,0,1]=4 376 B23R3.40833 O=C(NCCC1C(=O)Nc2c1cccc2)c3ccccc3 240690a_100000737811_100000185807 [0,0,0,0,0,1|2,0,1]=4 377 B23R3.40833 O=C(NCCn1c(=O)[nH]c2c1cccc2)c3ccccc3 11a_203549771432_100000185807 [0,0,0,0,0,1|3,0,0]=4 378 B23R3.40833 O=C(NCCn1c(=O)[nH]c2c1cccc2)c3ccccc3 240690a_203549771432_100000185807 [0,0,0,0,0,1|3,0,0]=4 379 B23R3.40833 O=C(NCCn1c(=O)[nH]c2c1cccc2)c3ccccc3 527a_203549771432_100000185807 [0,0,0,0,0,1|3,0,0]=4 380 B23R3.40843 Cc1[nH]c2ncccc2c1SCCNC(=O)n3cccn3 62a_100000070358_100010174266 [0,0,0,0,0,1|3,0,0]=4 381 B23R3.40843 Cc1nc2ccccc2n1CCOCC(=O)c3cccs3 7a_100000184870_100000211436 [0,0,0,0,0,1|2,0,1]=4 382 B23R3.40843 Cc1oc2ccccc2c1SCCNC(=O)n3cccn3 62a_100000070358_200010236113 [0,0,0,0,0,1|3,0,0]=4 383 B23R3.40843 Cc1sc2ccccc2c1SCCNC(=O)n3cccn3 62a_100000070358_100010002616 [0,0,0,0,0,1|3,0,0]=4 384 B23R3.40843 Cc1sc2ccccc2c1SCCNC(=O)n3cccn3 62a_100010002616_100000070358 [0,0,0,0,0,1|3,0,0]=4 385 B23R3.40844 Cc1[nH]c2ccccc2c1C=NNC(=O)Cc3cccs3 4a_100000189772_100000186307 [0,0,0,0,0,1|1,0,1]=3 386 B23R3.40844 Cc1[nH]c2ccccc2c1CCNC(=O)CC3=CCCC3 240690a_100000750322_100000050221 [0,0,0,0,0,1|1,0,2]=4 387 B23R3.40844 Cc1[nH]c2ccccc2c1CCNC(=O)CC3=CCCC3 527a_100000750322_100000050221 [0,0,0,0,0,1|1,0,2]=4 388 B23R3.40844 Cc1[nH]c2ccccc2c1CCNC(=O)CC3C=CCC3 240690a_100000750322_100000212241 [0,0,0,0,0,1|1,0,2]=4 389 B23R3.40844 Cc1[nH]c2ccccc2c1CCNC(=O)CC3C=CCC3 527a_100000750322_100000212241 [0,0,0,0,0,1|1,0,2]=4 390 B23R3.40844 Cc1[nH]c2ccccc2c1CCNC(=O)CC3CC=CC3 240690a_100000750322_200000137526 [0,0,0,0,0,1|1,0,2]=4 391 B23R3.40844 Cc1[nH]c2ccccc2c1CCNC(=O)CC3CC=CC3 527a_100000750322_200000137526 [0,0,0,0,0,1|1,0,2]=4 392 B23R3.40844 Cc1[nH]c2ccccc2c1CCNC(=O)Cc3c[nH]cn3 240690a_100000750322_100015291406 [0,0,0,0,0,1|2,0,0]=3 393 B23R3.40844 Cc1[nH]c2ccccc2c1CCNC(=O)Cc3ccc[nH]3 240690a_100000750322_100000238377 [0,0,0,0,0,1|1,0,0]=2 394 B23R3.40844 Cc1[nH]c2ccccc2c1CCNC(=O)Cc3ccc[nH]3 527a_100000750322_100000238377 [0,0,0,0,0,1|1,0,0]=2 395 B23R3.40844 Cc1[nH]c2ccccc2c1CCNC(=O)Cc3ccco3 527a_100000750322_100011217309 [0,0,0,0,0,1|0,1,0]=2 396 B23R3.40844 Cc1[nH]c2ccccc2c1CCNC(=O)Cc3cccs3 240690a_100000750322_100000210189 [0,0,0,0,0,1|0,0,0]=1 397 B23R3.40844 Cc1[nH]c2ccccc2c1CCNC(=O)Cc3ccn[nH]3 240690a_100000750322_100000752941 [0,0,0,0,0,1|2,0,0]=3 398 B23R3.40844 Cc1[nH]c2ccccc2c1CCNC(=O)Cc3ccn[nH]3 527a_100000750322_100000752941 [0,0,0,0,0,1|2,0,0]=3 399 B23R3.40844 Cc1[nH]c2ccccc2c1CCNC(=O)Cc3ccoc3 240690a_100000750322_100000684892 [0,0,0,0,0,1|2,0,0]=3 400 B23R3.40844 Cc1[nH]c2ccccc2c1CCNC(=O)Cc3ccoc3 527a_100000750322_100000684892 [0,0,0,0,0,1|2,0,0]=3 401 B23R3.40844 Cc1[nH]c2ccccc2c1CCNC(=O)Cc3ccsc3 240690a_100000750322_100000184062 [0,0,0,0,0,1|2,0,0]=3 402 B23R3.40844 Cc1[nH]c2ccccc2c1CCNC(=O)Cc3ccsc3 527a_100000750322_100000184062 [0,0,0,0,0,1|2,0,0]=3 403 B23R3.40844 Cc1[nH]c2ccccc2c1CCNC(=O)Cc3cscn3 240690a_100000750322_100011438297 [0,0,0,0,0,1|2,0,0]=3 404 B23R3.40844 Cc1[nH]c2ccccc2c1CCNC(=O)Cc3cscn3 527a_100000750322_100011438297 [0,0,0,0,0,1|2,0,0]=3 405 B23R3.40844 Cc1[nH]c2ccccc2c1CCNC(=O)Cn3cccc3 527a_100000750322_100011196272 [0,0,0,0,0,1|2,0,0]=3 406 B23R3.40844 Cc1[nH]c2ccccc2c1CCNC(=O)Cn3cccn3 240690a_100000750322_100000233772 [0,0,0,0,0,1|2,0,0]=3 407 B23R3.40844 Cc1[nH]c2ccccc2c1CCNC(=O)Cn3cccn3 527a_100000750322_100000233772 [0,0,0,0,0,1|2,0,0]=3 408 B23R3.40844 Cc1[nH]c2ccccc2c1CCNC(=O)Cn3ccnc3 240690a_100000750322_100000739072 [0,0,0,0,0,1|3,0,0]=4 409 B23R3.40844 Cc1[nH]c2ccccc2c1CCNC(=O)Cn3ccnn3 240690a_100000750322_100000080816 [0,0,0,0,0,1|3,0,0]=4 410 B23R3.40844 Cc1[nH]c2ccccc2c1CCNC(=O)Cn3cncn3 240690a_100000750322_100000699347 [0,0,0,0,0,1|3,0,0]=4 411 B23R3.40844 Cc1[nH]c2ccccc2c1CCNC(=O)Cn3nccn3 240690a_100000750322_100000080817 [0,0,0,0,0,1|3,0,0]=4 412 B23R3.40844 Cc1[nH]c2ccccc2c1CCNC(=O)Cn3nccn3 527a_100000750322_100000080817 [0,0,0,0,0,1|3,0,0]=4 413 B23R3.40844 Cc1[nH]c2ccccc2c1CCNC(=O)NC3C=CN=N3 2708a_100000750322_100134613517 [0,0,0,0,0,1|2,0,1]=4 414 B23R3.40844 Cc1[nH]c2ccccc2c1CCNC(=O)NC3C=CN=N3 273464a_100000750322_100134613517 [0,0,0,0,0,1|2,0,1]=4 415 B23R3.40844 Cc1[nH]c2ccccc2c1CCNC(=O)NC3C=CN=N3 273464a_100134613517_100000750322 [0,0,0,0,0,1|2,0,1]=4 416 B23R3.40844 Cc1[nH]c2ccccc2c1CCNC(=O)NC3C=CN=N3 512a_100000750322_100134613517 [0,0,0,0,0,1|2,0,1]=4 417 B23R3.40844 Cc1[nH]c2ccccc2c1CCNC(=O)NC3CC=CC3 2708a_100000750322_100015188752 [0,0,0,0,0,1|1,0,2]=4 418 B23R3.40844 Cc1[nH]c2ccccc2c1CCNC(=O)NC3CC=CC3 2708a_100015188752_100000750322 [0,0,0,0,0,1|1,0,2]=4 419 B23R3.40844 Cc1[nH]c2ccccc2c1CCNC(=O)NC3CC=CC3 273464a_100000750322_100015188752 [0,0,0,0,0,1|1,0,2]=4 420 B23R3.40844 Cc1[nH]c2ccccc2c1CCNC(=O)NC3CC=CC3 273464a_100015188752_100000750322 [0,0,0,0,0,1|1,0,2]=4 421 B23R3.40844 Cc1[nH]c2ccccc2c1CCNC(=O)NC3CC=CC3 512a_100000750322_100015188752 [0,0,0,0,0,1|1,0,2]=4 422 B23R3.40844 Cc1[nH]c2ccccc2c1CCNC(=O)NC3CC=CC3 512a_100015188752_100000750322 [0,0,0,0,0,1|1,0,2]=4 423 B23R3.40844 Cc1[nH]c2ccccc2c1CCNC(C)Cc3ccco3 270004a_100000750322_100011216958 [0,0,0,0,0,1|1,1,1]=4 424 B23R3.40844 Cc1nc2ccccc2n1CCNC(=O)Cc3ccc[nH]3 11a_200000204690_100000238377 [0,0,0,0,0,1|2,0,1]=4 425 B23R3.40844 Cc1nc2ccccc2n1CCNC(=O)Cc3ccc[nH]3 240690a_200000204690_100000238377 [0,0,0,0,0,1|2,0,1]=4 426 B23R3.40844 Cc1nc2ccccc2n1CCNC(=O)Cc3ccc[nH]3 527a_200000204690_100000238377 [0,0,0,0,0,1|2,0,1]=4 427 B23R3.40844 Cc1nc2ccccc2n1CCNC(=O)Cc3ccco3 11a_200000204690_100011217309 [0,0,0,0,0,1|1,1,1]=4 428 B23R3.40844 Cc1nc2ccccc2n1CCNC(=O)Cc3ccco3 527a_200000204690_100011217309 [0,0,0,0,0,1|1,1,1]=4 429 B23R3.40844 Cc1nc2ccccc2n1CCNC(=O)Cc3cccs3 11a_200000204690_100000210189 [0,0,0,0,0,1|1,0,1]=3 430 B23R3.40844 Cc1nc2ccccc2n1CCNC(=O)Cc3cccs3 1626a_200000204690_100000210189 [0,0,0,0,0,1|1,0,1]=3 431 B23R3.40844 Cc1nc2ccccc2n1CCNC(=O)Cc3cccs3 240690a_200000204690_100000210189 [0,0,0,0,0,1|1,0,1]=3 432 B23R3.40844 Cc1sc2ccccc2c1C=NNC(=O)Cc3cccs3 4a_100000189772_100000066825 [0,0,0,0,0,1|2,0,1]=4 433 B23R3.40844 O=C(CCCn1c(=O)[nH]c2c1cccc2)Cc3cccs3 1458a_100000210189_100000184716 [0,0,0,0,0,1|3,0,0]=4 434 B23R3.40844 O=C(Cc1ccc[nH]1)NCCC2C(=O)Nc3c2cccc3 240690a_100000737811_100000238377 [0,0,0,0,0,1|2,0,1]=4 435 B23R3.40844 O=C(Cc1ccc[nH]1)NCCn2c(=O)[nH]c3c2cccc3 11a_203549771432_100000238377 [0,0,0,0,0,1|3,0,0]=4 436 B23R3.40844 O=C(Cc1ccc[nH]1)NCCn2c(=O)[nH]c3c2cccc3 240690a_203549771432_100000238377 [0,0,0,0,0,1|3,0,0]=4 437 B23R3.40844 O=C(Cc1ccc[nH]1)NCCn2c(=O)[nH]c3c2cccc3 527a_203549771432_100000238377 [0,0,0,0,0,1|3,0,0]=4 438 B23R3.40844 O=C(Cc1ccco1)NCCn2c(=O)[nH]c3c2cccc3 11a_203549771432_100011217309 [0,0,0,0,0,1|2,1,0]=4 439 B23R3.40844 O=C(Cc1ccco1)NCCn2c(=O)[nH]c3c2cccc3 527a_203549771432_100011217309 [0,0,0,0,0,1|2,1,0]=4 440 B23R3.40844 O=C(Cc1cccs1)NCCC2C(=O)Nc3c2cccc3 240690a_100000737811_100000210189 [0,0,0,0,0,1|1,0,1]=3 441 B23R3.40844 O=C(Cc1cccs1)NCCn2c(=O)[nH]c3c2cccc3 11a_203549771432_100000210189 [0,0,0,0,0,1|2,0,0]=3 442 B23R3.40844 O=C(Cc1cccs1)NCCn2c(=O)[nH]c3c2cccc3 240690a_203549771432_100000210189 [0,0,0,0,0,1|2,0,0]=3 443 B23R3.40844 O=C(Cc1cccs1)NN=Cc2c([nH]c3c2cccc3)Br 4a_100000189772_100010159312 [0,0,0,0,0,1|2,0,1]=4 444 B23R3.40844 O=C(Cc1cccs1)NN=Cc2c([nH]c3c2cccc3)Cl 4a_100000189772_100000017700 [0,0,0,0,0,1|2,0,1]=4 445 B23R3.45341 Cc1ccc2ccccc2c1C=NNC(=O)c3cccs3 4a_100000184746_100011361466 [0,0,0,0,0,1|2,0,1]=4 446 B23R3.45341 Cc1ccc2ccccc2c1CSCC(=O)c3cccs3 62a_100000211436_100000689653 [0,0,0,0,0,1|3,0,0]=4 447 B23R3.45341 Cc1ccc2ccccc2c1CSCC(=O)c3cccs3 62a_100000689653_100000211436 [0,0,0,0,0,1|3,0,0]=4 448 B23R3.45341 Cc1ccc2ccccc2c1OCCC(=O)c3cccs3 7a_100000039261_100011290775 [0,0,0,0,0,1|3,0,0]=4 449 B23R3.45341 Cc1ccc2ccccc2c1SCCC(=O)c3cccs3 62a_100000759710_100011290775 [0,0,0,0,0,1|3,0,0]=4 450 B23R3.45341 Cc1ccc2ccccc2c1SCCC(=O)c3cccs3 62a_100011290775_100000759710 [0,0,0,0,0,1|3,0,0]=4 451 B23R3.45341 Cc1cnc2ccccc2c1SCCC(=O)c3cccs3 62a_100011290775_100000092342 [0,0,0,0,0,1|2,0,1]=4 452 B20R2.9 C/C=C/C=CC(=O)NCCc1c[nH]c2c1cccc2 240690a_100000211132_100000185730 [1,0,1,0,0,0|1,0,0]=3 453 B20R2.9 C/C=C/C=CC(=O)NCCc1coc2c1cccc2 11a_100011934666_100000185730 [1,0,1,0,0,0|2,0,0]=4 454 B20R2.9 C/C=C/C=CC(=O)NCCc1coc2c1cccc2 1626a_100011934666_100000185730 [1,0,1,0,0,0|2,0,0]=4 455 B20R2.9 C/C=C/C=CC(=O)NCCc1coc2c1cccc2 240690a_100011934666_100000185730 [1,0,1,0,0,0|2,0,0]=4 456 B20R2.9 C=CCSCC(=O)NCCc1c[nH]c2c1cccc2 240690a_100000211132_100000230395 [1,0,1,0,0,0|0,0,2]=4 457 B20R2.9 C=CCSCC(=O)NCCc1c[nH]c2c1cccc2 527a_100000211132_100000230395 [1,0,1,0,0,0|0,0,2]=4 458 B20R2.9 C=CCSCC(=O)NCCc1c[nH]c2c1cccc2 62a_100000187262_100000210623 [1,0,1,0,0,0|0,0,2]=4 459 B20R2.9 C=CCSCC(=O)NCCc1c[nH]c2c1cccc2 62a_100000210623_100000187262 [1,0,1,0,0,0|0,0,2]=4 460 B20R2.316121 C=CC=CC(=O)NCCn1c(nc2c1cccc2)C 1626a_200000204690_100016291481 [1,0,1,0,0,0|1,0,1]=4 461 B20R2.316121 C=CCCC(=O)NCCc1c([nH]c2c1cccc2)C 240690a_100000750322_100000749702 [1,0,1,0,0,0|0,0,2]=4 462 B20R2.316121 C=CCCC(=O)NCCc1c([nH]c2c1cccc2)C 527a_100000750322_100000749702 [1,0,1,0,0,0|0,0,2]=4 463 B20R2.316121 C=CCNC(=O)NCCc1c([nH]c2c1cccc2)C 2708a_100000750322_100020586998 [1,0,1,0,0,0|1,0,1]=4 464 B20R2.316121 C=CCNC(=O)NCCc1c([nH]c2c1cccc2)C 273464a_100000750322_100020586998 [1,0,1,0,0,0|1,0,1]=4 465 B20R2.316121 C=CCNC(=O)NCCc1c([nH]c2c1cccc2)C 273464a_100020586998_100000750322 [1,0,1,0,0,0|1,0,1]=4 466 B20R2.316121 C=CCNC(=O)NCCc1c([nH]c2c1cccc2)C 512a_100000750322_100020586998 [1,0,1,0,0,0|1,0,1]=4 467 B20R2.316121 C=CCNC(=O)NCCc1c([nH]c2c1cccc2)C 512a_100020586998_100000750322 [1,0,1,0,0,0|1,0,1]=4 468 B20R2.316121 CC=CCC(=O)NCCc1c([nH]c2c1cccc2)C 240690a_100000750322_100121576822 [1,0,1,0,0,0|0,0,2]=4 469 B20R2.316121 CC=CCC(=O)NCCc1c([nH]c2c1cccc2)C 527a_100000750322_100121576822 [1,0,1,0,0,0|0,0,2]=4 470 B20R2.316121 CCC=CC(=O)NCCc1c([nH]c2c1cccc2)C 240690a_100000750322_100000212282 [1,0,1,0,0,0|0,0,2]=4 471 B20R2.316121 COC=CC(=O)NCCc1c([nH]c2c1cccc2)C 240690a_100000750322_100016268678 [1,0,1,0,0,0|1,0,1]=4 472 B20R2.333329 C/C=C(/C=NNC(=O)c1cccs1)\c2ccccc2 4a_100000184746_200015352894 [1,0,1,0,0,0|1,0,1]=4 473 B20R2.327308 C=CC(C)C(=O)NCCc1c([nH]c2c1cccc2)C 240690a_100000750322_100011216780 [1,0,1,0,0,0|0,0,2]=4 474 B20R2.327308 C=CC(C)C(=O)NCCc1c([nH]c2c1cccc2)C 527a_100000750322_100011216780 [1,0,1,0,0,0|0,0,2]=4 475 B20R3.2713 c1ccc2c(c[nH]c2c1)CCNCc3cncs3 207a_100000211132_100000749870 [2,0,0,0,0,0|1,0,1]=4 476 B20R3.2713 c1ccc2c(c[nH]c2c1)CCNCc3cncs3 2230a_100000211132_100015185245 [2,0,0,0,0,0|1,0,1]=4 477 B20R3.2713 c1ccc2c(c[nH]c2c1)CCNCc3cncs3 2230a_100016987365_100011218569 [2,0,0,0,0,0|1,0,1]=4 478 B20R3.2713 c1ccc2c(c[nH]c2c1)CCNCc3cncs3 270004a_100000211132_100000749870 [2,0,0,0,0,0|1,0,1]=4 479 B20R3.2713 c1ccc2c(c[nH]c2c1)CCNCc3nccs3 207a_100000211132_100000750902 [2,0,0,0,0,0|1,0,1]=4 480 B20R3.2713 c1ccc2c(c[nH]c2c1)CCNCc3nccs3 2230a_100000211132_100015184050 [2,0,0,0,0,0|1,0,1]=4 481 B20R3.2713 c1ccc2c(c[nH]c2c1)CCNCc3nccs3 2230a_100000740555_100011218569 [2,0,0,0,0,0|1,0,1]=4 482 B20R3.2713 c1ccc2c(c[nH]c2c1)CCNCc3nccs3 270004a_100000211132_100000750902 [2,0,0,0,0,0|1,0,1]=4 483 B20R3.2713 c1coc(c1)CNCCc2c[nH]c3c2cccc3 207a_100000211132_100000186105 [2,0,0,0,0,0|0,1,1]=4 484 B20R3.2713 c1coc(c1)CNCCc2c[nH]c3c2cccc3 2230a_100000185738_100011218569 [2,0,0,0,0,0|0,1,1]=4 485 B20R3.2713 c1coc(c1)CNCCc2c[nH]c3c2cccc3 270004a_100000211132_100000186105 [2,0,0,0,0,0|0,1,1]=4 486 B20R3.2713 c1coc(c1)CNCCc2c[nH]c3c2cccc3 34a_100000185738_100011218569 [2,0,0,0,0,0|0,1,1]=4 487 B20R3.2713 c1csc(c1)CNCCc2c[nH]c3c2cccc3 207a_100000211132_100000209959 [2,0,0,0,0,0|0,0,1]=3 488 B20R3.2713 c1csc(c1)CNCCc2c[nH]c3c2cccc3 2230a_100000211653_100011218569 [2,0,0,0,0,0|0,0,1]=3 489 B20R3.2713 c1csc(c1)CNCCc2c[nH]c3c2cccc3 270004a_100000211132_100000209959 [2,0,0,0,0,0|0,0,1]=3 490 B20R3.2713 c1csc(c1)CNCCc2c[nH]c3c2cccn3 2230a_100000211653_100009895007 [2,0,0,0,0,0|1,0,1]=4 491 B20R3.2713 c1csc(c1)CNCCc2coc3c2cccc3 207a_100011934666_100000209959 [2,0,0,0,0,0|1,0,1]=4 492 B20R3.2713 c1csc(c1)CNCCc2coc3c2cccc3 270004a_100011934666_100000209959 [2,0,0,0,0,0|1,0,1]=4 493 B20R3.2713 c1csc(c1)COCCc2c[nH]c3c2cccc3 34a_100000211240_100011218569 [2,0,0,0,0,0|1,0,1]=4 494 B22R2.15488 CN(C(=O)CCCNC(=O)c1cccs1)c2ccccc2 11a_100000210012_100000194764 [0,1,1,0,0,0|1,0,1]=4 495 B22R2.15488 CN(C(=O)CCCNC(=O)c1cccs1)c2ccccc2 1626a_100000210012_100000194764 [0,1,1,0,0,0|1,0,1]=4 496 B22R2.15488 CN(C(=O)CCCNC(=O)c1cccs1)c2ccccc2 22a_100000210012_100000194764 [0,1,1,0,0,0|1,0,1]=4 497 B22R2.23706 Cc1ccc(cc1)NC(=O)CCCNC(=O)c2cccs2 11a_100000124888_100000194764 [0,1,1,0,0,0|1,0,1]=4 498 B22R2.23706 Cc1ccc(cc1)NC(=O)CCCNC(=O)c2cccs2 1626a_100000124888_100000194764 [0,1,1,0,0,0|1,0,1]=4 499 B22R2.23706 Cc1ccc(cc1)NC(=O)CCCNC(=O)c2cccs2 22a_100000124888_100000194764 [0,1,1,0,0,0|1,0,1]=4 500 B22R2.23706 Cc1ccc(cc1)NC(=O)CCCNC(=O)c2cccs2 527a_100000124888_100000194764 [0,1,1,0,0,0|1,0,1]=4 501 B22R2.23706 O=C(CCCNC(=O)c1cccs1)Nc2ccc(cc2)Br 11a_100000210018_100000194764 [0,1,1,0,0,0|1,0,1]=4 502 B22R2.23706 O=C(CCCNC(=O)c1cccs1)Nc2ccc(cc2)Br 1626a_100000210018_100000194764 [0,1,1,0,0,0|1,0,1]=4 503 B22R2.23706 O=C(CCCNC(=O)c1cccs1)Nc2ccc(cc2)Br 22a_100000210018_100000194764 [0,1,1,0,0,0|1,0,1]=4 504 B22R2.23706 O=C(CCCNC(=O)c1cccs1)Nc2ccc(cc2)Br 527a_100000210018_100000194764 [0,1,1,0,0,0|1,0,1]=4 505 B22R2.23706 O=C(CCCNC(=O)c1cccs1)Nc2ccc(cc2)Cl 11a_100000210052_100000194764 [0,1,1,0,0,0|1,0,1]=4 506 B22R2.23706 O=C(CCCNC(=O)c1cccs1)Nc2ccc(cc2)Cl 1626a_100000210052_100000194764 [0,1,1,0,0,0|1,0,1]=4 507 B22R2.23706 O=C(CCCNC(=O)c1cccs1)Nc2ccc(cc2)Cl 22a_100000210052_100000194764 [0,1,1,0,0,0|1,0,1]=4 508 B22R2.23706 O=C(CCCNC(=O)c1cccs1)Nc2ccc(cc2)Cl 527a_100000210052_100000194764 [0,1,1,0,0,0|1,0,1]=4 509 B22R2.23706 O=C(CCCNC(=O)c1cccs1)Nc2ccc(cc2)F 11a_100000185862_100000194764 [0,1,1,0,0,0|1,0,1]=4 510 B22R2.23706 O=C(CCCNC(=O)c1cccs1)Nc2ccc(cc2)F 1626a_100000185862_100000194764 [0,1,1,0,0,0|1,0,1]=4 511 B22R2.23706 O=C(CCCNC(=O)c1cccs1)Nc2ccc(cc2)F 22a_100000185862_100000194764 [0,1,1,0,0,0|1,0,1]=4 512 B22R2.23706 O=C(CCCNC(=O)c1cccs1)Nc2ccc(cc2)F 527a_100000185862_100000194764 [0,1,1,0,0,0|1,0,1]=4 513 B22R2.23706 O=C(CCCNC(=O)c1cccs1)Nc2ccc(cc2)I 11a_100000185761_100000194764 [0,1,1,0,0,0|1,0,1]=4 514 B22R2.23706 O=C(CCCNC(=O)c1cccs1)Nc2ccc(cc2)I 1626a_100000185761_100000194764 [0,1,1,0,0,0|1,0,1]=4 515 B22R2.23706 O=C(CCCNC(=O)c1cccs1)Nc2ccc(cc2)I 22a_100000185761_100000194764 [0,1,1,0,0,0|1,0,1]=4 516 B22R2.23706 O=C(CCCNC(=O)c1cccs1)Nc2ccc(cc2)I 527a_100000185761_100000194764 [0,1,1,0,0,0|1,0,1]=4 517 B22R2.23706 O=C(CCCNC(=O)c1cccs1)Nc2ccc(cc2)O 22a_100000185829_100000194764 [0,1,1,0,0,0|1,0,1]=4 518 B22R2.34124 CC(Cc1ccccc1)C(=O)CCNC(=O)c2cccs2 1458a_100000195306_200011218536 [0,1,1,0,0,0|1,0,1]=4 519 B22R2.34124 CN(Cc1ccccc1)C(=O)CCNC(=O)c2cccs2 11a_100000186898_100000195306 [0,1,1,0,0,0|2,0,0]=4 520 B22R2.34124 CN(Cc1ccccc1)C(=O)CCNC(=O)c2cccs2 1626a_100000186898_100000195306 [0,1,1,0,0,0|2,0,0]=4 521 B22R2.34124 CN(Cc1ccccc1)C(=O)CCNC(=O)c2cccs2 240690a_100000186898_100000195306 [0,1,1,0,0,0|2,0,0]=4 522 B22R2.34124 CN(Cc1ccccc1)C(=O)CCNC(=O)c2cccs2 527a_100000186898_100000195306 [0,1,1,0,0,0|2,0,0]=4 523 B22R2.143990 Cc1ccccc1NC(=O)CCCNC(=O)c2cccs2 11a_100015192222_100000194764 [0,1,1,0,0,0|1,0,1]=4 524 B22R2.143990 Cc1ccccc1NC(=O)CCCNC(=O)c2cccs2 1626a_100015192222_100000194764 [0,1,1,0,0,0|1,0,1]=4 525 B22R2.143990 Cc1ccccc1NC(=O)CCCNC(=O)c2cccs2 22a_100015192222_100000194764 [0,1,1,0,0,0|1,0,1]=4 526 B22R2.143990 Cc1ccccc1NC(=O)CCCNC(=O)c2cccs2 527a_100015192222_100000194764 [0,1,1,0,0,0|1,0,1]=4 527 B22R2.143990 O=C(CCCNC(=O)c1cccs1)Nc2ccccc2Br 11a_100000210017_100000194764 [0,1,1,0,0,0|1,0,1]=4 528 B22R2.143990 O=C(CCCNC(=O)c1cccs1)Nc2ccccc2Br 1626a_100000210017_100000194764 [0,1,1,0,0,0|1,0,1]=4 529 B22R2.143990 O=C(CCCNC(=O)c1cccs1)Nc2ccccc2Cl 11a_100000185783_100000194764 [0,1,1,0,0,0|1,0,1]=4 530 B22R2.143990 O=C(CCCNC(=O)c1cccs1)Nc2ccccc2Cl 1626a_100000185783_100000194764 [0,1,1,0,0,0|1,0,1]=4 531 B22R2.143990 O=C(CCCNC(=O)c1cccs1)Nc2ccccc2Cl 22a_100000185783_100000194764 [0,1,1,0,0,0|1,0,1]=4 532 B22R2.143990 O=C(CCCNC(=O)c1cccs1)Nc2ccccc2Cl 527a_100000185783_100000194764 [0,1,1,0,0,0|1,0,1]=4 533 B22R2.143990 O=C(CCCNC(=O)c1cccs1)Nc2ccccc2F 11a_100000210422_100000194764 [0,1,1,0,0,0|1,0,1]=4 534 B22R2.143990 O=C(CCCNC(=O)c1cccs1)Nc2ccccc2F 1626a_100000210422_100000194764 [0,1,1,0,0,0|1,0,1]=4 535 B22R2.143990 O=C(CCCNC(=O)c1cccs1)Nc2ccccc2F 22a_100000210422_100000194764 [0,1,1,0,0,0|1,0,1]=4 536 B22R2.143990 O=C(CCCNC(=O)c1cccs1)Nc2ccccc2F 527a_100000210422_100000194764 [0,1,1,0,0,0|1,0,1]=4 537 B22R2.143990 O=C(CCCNC(=O)c1cccs1)Nc2ccccc2I 11a_100000210053_100000194764 [0,1,1,0,0,0|1,0,1]=4 538 B22R2.143990 O=C(CCCNC(=O)c1cccs1)Nc2ccccc2I 1626a_100000210053_100000194764 [0,1,1,0,0,0|1,0,1]=4 539 B22R2.143990 O=C(CCCNC(=O)c1cccs1)Nc2ccccc2O 22a_100000185747_100000194764 [0,1,1,0,0,0|1,0,1]=4 540 B22R2.143990 O=C(CCCNC(=O)c1cccs1)Nc2ccccc2O 527a_100000185747_100000194764 [0,1,1,0,0,0|1,0,1]=4 541 B22R2.305060 Cc1cccc(c1)NC(=O)CCCNC(=O)c2cccs2 11a_100000188690_100000194764 [0,1,1,0,0,0|1,0,1]=4 542 B22R2.305060 Cc1cccc(c1)NC(=O)CCCNC(=O)c2cccs2 1626a_100000188690_100000194764 [0,1,1,0,0,0|1,0,1]=4 543 B22R2.305060 Cc1cccc(c1)NC(=O)CCCNC(=O)c2cccs2 22a_100000188690_100000194764 [0,1,1,0,0,0|1,0,1]=4 544 B22R2.305060 Cc1cccc(c1)NC(=O)CCCNC(=O)c2cccs2 527a_100000188690_100000194764 [0,1,1,0,0,0|1,0,1]=4 545 B22R2.305060 O=C(CCCNC(=O)c1cccs1)Nc2cccc(c2)Br 11a_100000210019_100000194764 [0,1,1,0,0,0|1,0,1]=4 546 B22R2.305060 O=C(CCCNC(=O)c1cccs1)Nc2cccc(c2)Br 1626a_100000210019_100000194764 [0,1,1,0,0,0|1,0,1]=4 547 B22R2.305060 O=C(CCCNC(=O)c1cccs1)Nc2cccc(c2)Br 22a_100000210019_100000194764 [0,1,1,0,0,0|1,0,1]=4 548 B22R2.305060 O=C(CCCNC(=O)c1cccs1)Nc2cccc(c2)Br 527a_100000210019_100000194764 [0,1,1,0,0,0|1,0,1]=4 549 B22R2.305060 O=C(CCCNC(=O)c1cccs1)Nc2cccc(c2)Cl 11a_100000185859_100000194764 [0,1,1,0,0,0|1,0,1]=4 550 B22R2.305060 O=C(CCCNC(=O)c1cccs1)Nc2cccc(c2)Cl 1626a_100000185859_100000194764 [0,1,1,0,0,0|1,0,1]=4 551 B22R2.305060 O=C(CCCNC(=O)c1cccs1)Nc2cccc(c2)Cl 22a_100000185859_100000194764 [0,1,1,0,0,0|1,0,1]=4 552 B22R2.305060 O=C(CCCNC(=O)c1cccs1)Nc2cccc(c2)F 11a_100000210047_100000194764 [0,1,1,0,0,0|1,0,1]=4 553 B22R2.305060 O=C(CCCNC(=O)c1cccs1)Nc2cccc(c2)F 1626a_100000210047_100000194764 [0,1,1,0,0,0|1,0,1]=4 554 B22R2.305060 O=C(CCCNC(=O)c1cccs1)Nc2cccc(c2)F 22a_100000210047_100000194764 [0,1,1,0,0,0|1,0,1]=4 555 B22R2.305060 O=C(CCCNC(=O)c1cccs1)Nc2cccc(c2)F 527a_100000210047_100000194764 [0,1,1,0,0,0|1,0,1]=4 556 B22R2.305060 O=C(CCCNC(=O)c1cccs1)Nc2cccc(c2)I 11a_100000211102_100000194764 [0,1,1,0,0,0|1,0,1]=4 557 B22R2.305060 O=C(CCCNC(=O)c1cccs1)Nc2cccc(c2)I 1626a_100000211102_100000194764 [0,1,1,0,0,0|1,0,1]=4 558 B22R2.305060 O=C(CCCNC(=O)c1cccs1)Nc2cccc(c2)I 22a_100000211102_100000194764 [0,1,1,0,0,0|1,0,1]=4 559 B22R2.305060 O=C(CCCNC(=O)c1cccs1)Nc2cccc(c2)I 527a_100000211102_100000194764 [0,1,1,0,0,0|1,0,1]=4 560 B22R2.305060 O=C(CCCNC(=O)c1cccs1)Nc2cccc(c2)O 1626a_100000210217_100000194764 [0,1,1,0,0,0|1,0,1]=4 561 B22R2.305060 O=C(CCCNC(=O)c1cccs1)Nc2cccc(c2)O 22a_100000210217_100000194764 [0,1,1,0,0,0|1,0,1]=4 562 B22R2.305060 O=C(CCCNC(=O)c1cccs1)Nc2cccc(c2)O 527a_100000210217_100000194764 [0,1,1,0,0,0|1,0,1]=4 563 B22R2.2082074 C=CCSC(C)C(=O)NCCc1c([nH]c2c1cccc2)C 240690a_100000750322_100000230602 [0,1,1,0,0,0|0,0,2]=4 564 B22R2.2082074 C=CCSC(C)C(=O)NCCc1c([nH]c2c1cccc2)C 527a_100000750322_100000230602 [0,1,1,0,0,0|0,0,2]=4 565 B22R2.8938337 C=CC(=O)NCC(=O)NCCc1c([nH]c2c1cccc2)C 240690a_100000750322_200011222540 [0,1,1,0,0,0|1,0,1]=4 566 B22R2.8938337 C=CC(=O)NCC(=O)NCCc1c([nH]c2c1cccc2)C 527a_100000750322_200011222540 [0,1,1,0,0,0|1,0,1]=4 567 B22R2.9842526 C/C=C/C=CC(=O)NCCc1c([nH]c2c1cc(cc2)C)C 11a_100000076026_100000185730 [0,1,1,0,0,0|1,0,0]=3 568 B22R2.9842526 C/C=C/C=CC(=O)NCCc1c([nH]c2c1cc(cc2)C)C 240690a_100000076026_100000185730 [0,1,1,0,0,0|1,0,0]=3 569 B22R2.9842526 C/C=C/C=CC(=O)NCCc1c([nH]c2c1cc(cc2)F)C 11a_100015200695_100000185730 [0,1,1,0,0,0|1,0,0]=3 570 B22R2.9842526 C/C=C/C=CC(=O)NCCc1c([nH]c2c1cc(cc2)F)C 240690a_100015200695_100000185730 [0,1,1,0,0,0|1,0,0]=3 571 B22R2.9842526 C=CCSCC(=O)NCCc1c([nH]c2c1cc(cc2)C)C 11a_100000076026_100000230395 [0,1,1,0,0,0|0,0,2]=4 572 B22R2.9842526 C=CCSCC(=O)NCCc1c([nH]c2c1cc(cc2)C)C 240690a_100000076026_100000230395 [0,1,1,0,0,0|0,0,2]=4 573 B22R2.9842526 C=CCSCC(=O)NCCc1c([nH]c2c1cc(cc2)C)C 527a_100000076026_100000230395 [0,1,1,0,0,0|0,0,2]=4 574 B22R2.9842526 C=CCSCC(=O)NCCc1c([nH]c2c1cc(cc2)F)C 11a_100015200695_100000230395 [0,1,1,0,0,0|0,0,2]=4 575 B22R2.9842526 C=CCSCC(=O)NCCc1c([nH]c2c1cc(cc2)F)C 240690a_100015200695_100000230395 [0,1,1,0,0,0|0,0,2]=4 576 B22R2.9842526 C=CCSCC(=O)NCCc1c([nH]c2c1cc(cc2)F)C 527a_100015200695_100000230395 [0,1,1,0,0,0|0,0,2]=4 577 B22R2.290765 C=C(NC(=O)C)C(=O)NCCc1c([nH]c2c1cccc2)C 240690a_100000750322_100000758921 [0,1,1,0,0,0|1,0,1]=4 578 B22R3.799 CC(c1cccs1)N(C)CCc2c[nH]c3c2cccc3 2230a_100000186410_100011218569 [1,1,0,0,0,0|1,0,1]=4 579 B22R3.799 CC(c1cccs1)N(C)CCc2c[nH]c3c2cccc3 269982a_100000186410_100011218569 [1,1,0,0,0,0|1,0,1]=4 580 B22R3.4216 CC(Cc1c[nH]c2c1cccc2)NC(C)c3cccs3 270004a_100000703493_100000030300 [1,1,0,0,0,0|1,0,1]=4 581 B22R3.4216 O=C(CC(=O)c1cccs1)Cc2c[nH]c3c2cccc3 1458a_100000183835_100000211436 [1,1,0,0,0,0|1,0,1]=4 582 B22R3.10060 CCC(NCCc1c[nH]c2c1cccc2)c3cccs3 2230a_100000743277_100011218569 [1,1,0,0,0,0|1,0,1]=4 583 B22R3.10060 CCC(NCCc1c[nH]c2c1cccc2)c3cccs3 269862a_100000211132_100000211688 [1,1,0,0,0,0|1,0,1]=4 584 B22R3.10060 OCC(NCCc1c[nH]c2c1cccc2)c3cccs3 2230a_100102422791_100011218569 [1,1,0,0,0,0|0,0,2]=4 585 B22R3.12303 CC(NCCc1c[nH]c2c1ccc(c2)F)c3cccs3 269862a_100000709932_100000185736 [1,1,0,0,0,0|1,0,1]=4 586 B22R3.12303 Cc1ccc2c(c[nH]c2c1)C=NNC(=O)c3cccs3 4a_100000184746_100000743239 [1,1,0,0,0,0|1,0,1]=4 587 B22R3.12303 Cc1ccc2c(c[nH]c2c1)CCNC(C)c3cccs3 269862a_100000709966_100000185736 [1,1,0,0,0,0|1,0,1]=4 588 B22R3.12303 O=C(NN=Cc1c[nH]c2c1ccc(c2)Br)c3cccs3 4a_100000184746_100011361519 [1,1,0,0,0,0|1,0,1]=4 589 B22R3.12303 O=C(NN=Cc1c[nH]c2c1ccc(c2)Cl)c3cccs3 4a_100000184746_100000743236 [1,1,0,0,0,0|1,0,1]=4 590 B22R3.12303 O=C(NN=Cc1c[nH]c2c1ccc(c2)F)c3cccs3 4a_100000184746_100000743237 [1,1,0,0,0,0|1,0,1]=4 591 B22R3.65289 CC(NCCc1c[nH]c2c1cccc2)c3sccc3Br 269862a_100000211132_100000738688 [1,1,0,0,0,0|1,0,1]=4 592 B22R3.65289 Cc1ccsc1C(=O)NN=Cc2c[nH]c3c2cccc3 4a_100000189776_100000182151 [1,1,0,0,0,0|1,0,1]=4 593 B22R3.65289 O=C(NN=Cc1c[nH]c2c1cccc2)c3sccc3Cl 4a_100012021866_100000182151 [1,1,0,0,0,0|1,0,1]=4 594 B22R3.212962 CC(=NNC(=O)c1cccs1)c2c[nH]c3c2cccc3 4a_100000184746_100000187069 [1,1,0,0,0,0|1,0,1]=4 595 B22R3.226875 CC(NCCc1c[nH]c2c1cccc2)c3cc(cs3)Br 2230a_100159270200_100011218569 [1,1,0,0,0,0|1,0,1]=4 596 B22R3.226875 CC(NCCc1c[nH]c2c1cccc2)c3cc(cs3)Br 269862a_100000211132_100000718618 [1,1,0,0,0,0|1,0,1]=4 597 B22R3.226875 CC(NCCc1c[nH]c2c1cccc2)c3cc(cs3)Br 34a_100159270200_100011218569 [1,1,0,0,0,0|1,0,1]=4 598 B22R3.226875 CC(NCCc1c[nH]c2c1cccc2)c3cc(cs3)Cl 269862a_100000211132_100000061699 [1,1,0,0,0,0|1,0,1]=4 599 B22R3.226875 CC(NCCc1c[nH]c2c1cccc2)c3ccc(s3)Br 2230a_100102723530_100011218569 [1,1,0,0,0,0|1,0,1]=4 600 B22R3.226875 CC(NCCc1c[nH]c2c1cccc2)c3ccc(s3)Br 269862a_100000211132_100000183331 [1,1,0,0,0,0|1,0,1]=4 601 B22R3.226875 CC(NCCc1c[nH]c2c1cccc2)c3ccc(s3)Cl 2230a_100102723459_100011218569 [1,1,0,0,0,0|1,0,1]=4 602 B22R3.226875 CC(NCCc1c[nH]c2c1cccc2)c3ccc(s3)Cl 269862a_100000211132_100000182421 [1,1,0,0,0,0|1,0,1]=4 603 B22R3.226875 CC(NCCc1c[nH]c2c1cccc2)c3ccc(s3)I 269862a_100000211132_200000034408 [1,1,0,0,0,0|1,0,1]=4 604 B22R3.226875 Cc1ccc(s1)C(=O)NN=Cc2c[nH]c3c2cccc3 4a_100000189777_100000182151 [1,1,0,0,0,0|1,0,1]=4 605 B22R3.226875 Cc1ccc(s1)C(C)NCCc2c[nH]c3c2cccc3 269862a_100000211132_100000195387 [1,1,0,0,0,0|1,0,1]=4 606 B22R3.226875 Cc1csc(c1)C(=O)NN=Cc2c[nH]c3c2cccc3 4a_100000143654_100000182151 [1,1,0,0,0,0|1,0,1]=4 607 B22R3.226875 Cc1csc(c1)C(C)NCCc2c[nH]c3c2cccc3 269862a_100000211132_100000034720 [1,1,0,0,0,0|1,0,1]=4 608 B22R3.226875 O=C(NN=Cc1c[nH]c2c1cccc2)c3ccc(s3)Br 4a_100000180196_100000182151 [1,1,0,0,0,0|1,0,1]=4 609 B22R3.226875 O=C(NN=Cc1c[nH]c2c1cccc2)c3ccc(s3)Cl 4a_100000189877_100000182151 [1,1,0,0,0,0|1,0,1]=4 610 B22R3.248999 CC(C)(NCCc1c[nH]c2c1cccc2)c3cccs3 2230a_100000757009_100011218569 [1,1,0,0,0,0|1,0,1]=4 611 B22R3.248999 O=S(=O)(NCCc1c[nH]c2c1cccc2)c3ccco3 274078a_100000211132_200000702926 [1,1,0,0,0,0|1,1,0]=4 612 B22R3.248999 O=S(=O)(NCCc1c[nH]c2c1cccc2)c3cccs3 274078a_100000211132_100000205146 [1,1,0,0,0,0|1,0,0]=3 613 B22R3.248999 O=S(=O)(NCCc1c[nH]c2c1cccc2)c3cccs3 40a_100000211132_200000102146 [1,1,0,0,0,0|1,0,0]=3 614 B22R3.248999 O=S(=O)(NCCc1coc2c1cccc2)c3cccs3 270084a_100011934666_100000205146 [1,1,0,0,0,0|2,0,0]=4 615 B22R3.248999 O=S(=O)(NCCc1coc2c1cccc2)c3cccs3 274078a_100011934666_100000205146 [1,1,0,0,0,0|2,0,0]=4 616 B22R3.248999 O=S(=O)(NCCc1coc2c1cccc2)c3cccs3 40a_100011934666_200000102146 [1,1,0,0,0,0|2,0,0]=4 617 B22R3.368518 CC(NCCc1c[nH]c2c1cc(cc2)Br)c3cccs3 269862a_100016990496_100000185736 [1,1,0,0,0,0|1,0,1]=4 618 B22R3.368518 CC(NCCc1c[nH]c2c1cc(cc2)Cl)c3cccs3 269862a_100000763428_100000185736 [1,1,0,0,0,0|1,0,1]=4 619 B22R3.368518 CC(NCCc1c[nH]c2c1cc(cc2)F)c3cccs3 269862a_100000725365_100000185736 [1,1,0,0,0,0|1,0,1]=4 620 B22R3.368518 Cc1ccc2[nH]cc(c2c1)C=NNC(=O)c3cccs3 4a_100000184746_100000757390 [1,1,0,0,0,0|1,0,1]=4 621 B22R3.368518 Cc1ccc2[nH]cc(c2c1)CCNC(C)c3cccs3 269862a_100000008874_100000185736 [1,1,0,0,0,0|1,0,1]=4 622 B22R3.368518 O=C(NN=Cc1c[nH]c2c1cc(cc2)Br)c3cccs3 4a_100000184746_100000187850 [1,1,0,0,0,0|1,0,1]=4 623 B22R3.368518 O=C(NN=Cc1c[nH]c2c1cc(cc2)Cl)c3cccs3 4a_100000184746_100011218521 [1,1,0,0,0,0|1,0,1]=4 624 B22R3.368518 O=C(NN=Cc1c[nH]c2c1cc(cc2)F)c3cccs3 4a_100000184746_100000747633 [1,1,0,0,0,0|1,0,1]=4 625 B22R3.368518 O=C(NN=Cc1c[nH]c2c1cc(cc2)I)c3cccs3 4a_100000184746_100010871809 [1,1,0,0,0,0|1,0,1]=4 626 B22R3.368518 O=C(NN=Cc1c[nH]c2c1cc(cc2)O)c3cccs3 4a_100000184746_100000059740 [1,1,0,0,0,0|1,0,1]=4 627 B22R3.606964 Cc1cccc2c1[nH]cc2C=NNC(=O)c3cccs3 4a_100000184746_100000040139 [1,1,0,0,0,0|1,0,1]=4 628 B22R3.606964 Cc1cccc2c1[nH]cc2CCNC(C)c3cccs3 269862a_100015184521_100000185736 [1,1,0,0,0,0|1,0,1]=4 629 B22R3.606964 O=C(NN=Cc1c[nH]c2c1cccc2Br)c3cccs3 4a_100000184746_100009814786 [1,1,0,0,0,0|1,0,1]=4 630 B22R3.606964 O=C(NN=Cc1c[nH]c2c1cccc2Cl)c3cccs3 4a_100000184746_100011361501 [1,1,0,0,0,0|1,0,1]=4 631 B22R3.608912 Cc1cccc2c1c(c[nH]2)C=NNC(=O)c3cccs3 4a_100000184746_100000743823 [1,1,0,0,0,0|1,0,1]=4 632 B22R3.608912 O=C(NN=Cc1c[nH]c2c1c(ccc2)Br)c3cccs3 4a_100000184746_100000693042 [1,1,0,0,0,0|1,0,1]=4 633 B22R3.608912 O=C(NN=Cc1c[nH]c2c1c(ccc2)Cl)c3cccs3 4a_100000184746_100011934431 [1,1,0,0,0,0|1,0,1]=4 634 B22R3.608912 O=C(NN=Cc1c[nH]c2c1c(ccc2)F)c3cccs3 4a_100000184746_100000684713 [1,1,0,0,0,0|1,0,1]=4 635 B22R3.608912 O=C(NN=Cc1c[nH]c2c1c(ccc2)O)c3cccs3 4a_100000184746_100000050372 [1,1,0,0,0,0|1,0,1]=4 636 B22R3.2853124 Cn1cc(c2c1cccc2)C=NNC(=O)c3cccs3 4a_100000184746_100000182148 [1,1,0,0,0,0|1,0,1]=4 637 B22R3.647657 Cc1[nH]c2ccccc2c1CC(=O)NCc3cccs3 11a_100000211653_100000737320 [1,1,0,0,0,0|0,0,2]=4 638 B22R3.647657 Cc1[nH]c2ccccc2c1CC(=O)NCc3cccs3 240690a_100000211653_100000737320 [1,1,0,0,0,0|0,0,2]=4 639 B22R3.647657 Cc1[nH]c2ccccc2c1CC(=O)NCc3cccs3 527a_100000211653_100000737320 [1,1,0,0,0,0|0,0,2]=4 640 B22R3.647660 Cc1[nH]c2ccccc2c1C(=O)CNCc3cccs3 2230a_100000211653_100000182688 [1,1,0,0,0,0|0,0,2]=4 641 B22R3.5290014 Cc1[nH]c2ccccc2c1CCNCc3cc(c[nH]3)Br 270004a_100000750322_100000720742 [1,1,0,0,0,0|1,0,1]=4 642 B22R3.5290014 Cc1[nH]c2ccccc2c1CCNCc3cc(co3)Br 270004a_100000750322_100000747035 [1,1,0,0,0,0|0,1,1]=4 643 B22R3.5290014 Cc1[nH]c2ccccc2c1CCNCc3cc(cs3)Br 207a_100000750322_100000211722 [1,1,0,0,0,0|0,0,1]=3 644 B22R3.5290014 Cc1[nH]c2ccccc2c1CCNCc3cc(cs3)Br 270004a_100000750322_100000211722 [1,1,0,0,0,0|0,0,1]=3 645 B22R3.5290014 Cc1[nH]c2ccccc2c1CCNCc3cc(cs3)Cl 207a_100000750322_100000102487 [1,1,0,0,0,0|0,0,1]=3 646 B22R3.5290014 Cc1[nH]c2ccccc2c1CCNCc3cc(cs3)Cl 270004a_100000750322_100000102487 [1,1,0,0,0,0|0,0,1]=3 647 B22R3.5290014 Cc1[nH]c2ccccc2c1CCNCc3cc(cs3)I 207a_100000750322_100010179861 [1,1,0,0,0,0|0,0,1]=3 648 B22R3.5290014 Cc1[nH]c2ccccc2c1CCNCc3ccc(o3)Br 207a_100000750322_100000185145 [1,1,0,0,0,0|0,1,1]=4 649 B22R3.5290014 Cc1[nH]c2ccccc2c1CCNCc3ccc(o3)Br 270004a_100000750322_100000185145 [1,1,0,0,0,0|0,1,1]=4 650 B22R3.5290014 Cc1[nH]c2ccccc2c1CCNCc3ccc(o3)Cl 207a_100000750322_100000188459 [1,1,0,0,0,0|0,1,1]=4 651 B22R3.5290014 Cc1[nH]c2ccccc2c1CCNCc3ccc(o3)Cl 270004a_100000750322_100000188459 [1,1,0,0,0,0|0,1,1]=4 652 B22R3.5290014 Cc1[nH]c2ccccc2c1CCNCc3ccc(o3)I 207a_100000750322_100000186757 [1,1,0,0,0,0|0,1,1]=4 653 B22R3.5290014 Cc1[nH]c2ccccc2c1CCNCc3ccc(s3)Br 207a_100000750322_100000179771 [1,1,0,0,0,0|0,0,1]=3 654 B22R3.5290014 Cc1[nH]c2ccccc2c1CCNCc3ccc(s3)Br 270004a_100000750322_100000179771 [1,1,0,0,0,0|0,0,1]=3 655 B22R3.5290014 Cc1[nH]c2ccccc2c1CCNCc3ccc(s3)Cl 207a_100000750322_100000242774 [1,1,0,0,0,0|0,0,1]=3 656 B22R3.5290014 Cc1[nH]c2ccccc2c1CCNCc3ccc(s3)Cl 270004a_100000750322_100000242774 [1,1,0,0,0,0|0,0,1]=3 657 B22R3.5290014 Cc1[nH]c2ccccc2c1CCNCc3cnc(s3)Br 270004a_100000750322_100009814069 [1,1,0,0,0,0|1,0,1]=4 658 B22R3.5290014 Cc1[nH]c2ccccc2c1CCNCc3cnc(s3)Cl 270004a_100000750322_100000696999 [1,1,0,0,0,0|1,0,1]=4 659 B22R3.5290014 Cc1[nH]c2ccccc2c1CCNCc3nc(cs3)Br 270004a_100000750322_100009816814 [1,1,0,0,0,0|1,0,1]=4 660 B22R3.5290014 Cc1[nH]c2ccccc2c1CCNCc3ncc(s3)Br 270004a_100000750322_100000699580 [1,1,0,0,0,0|1,0,1]=4 661 B22R3.5290014 Cc1[nH]c2ccccc2c1CCNCc3ncc(s3)Cl 270004a_100000750322_100000699884 [1,1,0,0,0,0|1,0,1]=4 662 B22R3.5290014 Cc1ccc(o1)CNCCc2c([nH]c3c2cccc3)C 207a_100000750322_100000183696 [1,1,0,0,0,0|0,1,1]=4 663 B22R3.5290014 Cc1ccc(o1)CNCCc2c([nH]c3c2cccc3)C 270004a_100000750322_100000183696 [1,1,0,0,0,0|0,1,1]=4 664 B22R3.5290014 Cc1ccc(s1)CNCCc2c([nH]c3c2cccc3)C 207a_100000750322_100000211121 [1,1,0,0,0,0|0,0,1]=3 665 B22R3.5290014 Cc1ccc(s1)CNCCc2c([nH]c3c2cccc3)C 270004a_100000750322_100000211121 [1,1,0,0,0,0|0,0,1]=3 666 B22R3.5290014 Cc1cnc(s1)CNCCc2c([nH]c3c2cccc3)C 207a_100000750322_100011361622 [1,1,0,0,0,0|1,0,1]=4 667 B22R3.5290014 Cc1cnc(s1)CNCCc2c([nH]c3c2cccc3)C 270004a_100000750322_100011361622 [1,1,0,0,0,0|1,0,1]=4 668 B22R3.5290014 Cc1csc(c1)CNCCc2c([nH]c3c2cccc3)C 207a_100000750322_100102525248 [1,1,0,0,0,0|0,0,1]=3 669 B22R3.5290014 Cc1csc(c1)CNCCc2c([nH]c3c2cccc3)C 270004a_100000750322_100102525248 [1,1,0,0,0,0|0,0,1]=3 670 B22R3.5290014 Cc1csc(n1)CNCCc2c([nH]c3c2cccc3)C 207a_100000750322_100000756994 [1,1,0,0,0,0|1,0,1]=4 671 B22R3.5290014 Cc1csc(n1)CNCCc2c([nH]c3c2cccc3)C 270004a_100000750322_100000756994 [1,1,0,0,0,0|1,0,1]=4 672 B22R3.5290014 Cc1ncc(s1)CNCCc2c([nH]c3c2cccc3)C 207a_100000750322_100000740557 [1,1,0,0,0,0|1,0,1]=4 673 B22R3.5290014 Cc1ncc(s1)CNCCc2c([nH]c3c2cccc3)C 270004a_100000750322_100000740557 [1,1,0,0,0,0|1,0,1]=4 674 B22R3.5485654 Cc1[nH]c2ccc(cc2c1CCNCc3ccco3)F 207a_100015200695_100000186105 [1,1,0,0,0,0|0,1,1]=4 675 B22R3.5485654 Cc1[nH]c2ccc(cc2c1CCNCc3ccco3)F 270004a_100015200695_100000186105 [1,1,0,0,0,0|0,1,1]=4 676 B22R3.5485654 Cc1[nH]c2ccc(cc2c1CCNCc3cccs3)F 207a_100015200695_100000209959 [1,1,0,0,0,0|0,0,1]=3 677 B22R3.5485654 Cc1[nH]c2ccc(cc2c1CCNCc3cccs3)F 270004a_100015200695_100000209959 [1,1,0,0,0,0|0,0,1]=3 678 B22R3.5485654 Cc1[nH]c2ccc(cc2c1CCNCc3cncs3)F 207a_100015200695_100000749870 [1,1,0,0,0,0|1,0,1]=4 679 B22R3.5485654 Cc1[nH]c2ccc(cc2c1CCNCc3cncs3)F 270004a_100015200695_100000749870 [1,1,0,0,0,0|1,0,1]=4 680 B22R3.5485654 Cc1[nH]c2ccc(cc2c1CCNCc3nccs3)F 207a_100015200695_100000750902 [1,1,0,0,0,0|1,0,1]=4 681 B22R3.5485654 Cc1[nH]c2ccc(cc2c1CCNCc3nccs3)F 270004a_100015200695_100000750902 [1,1,0,0,0,0|1,0,1]=4 682 B22R3.5485654 Cc1ccc2[nH]c(c(c2c1)CCNCc3ccco3)C 207a_100000076026_100000186105 [1,1,0,0,0,0|0,1,1]=4 683 B22R3.5485654 Cc1ccc2[nH]c(c(c2c1)CCNCc3ccco3)C 270004a_100000076026_100000186105 [1,1,0,0,0,0|0,1,1]=4 684 B22R3.5485654 Cc1ccc2[nH]c(c(c2c1)CCNCc3cccs3)C 207a_100000076026_100000209959 [1,1,0,0,0,0|0,0,1]=3 685 B22R3.5485654 Cc1ccc2[nH]c(c(c2c1)CCNCc3cccs3)C 270004a_100000076026_100000209959 [1,1,0,0,0,0|0,0,1]=3 686 B22R3.5485654 Cc1ccc2[nH]c(c(c2c1)CCNCc3cncs3)C 207a_100000076026_100000749870 [1,1,0,0,0,0|1,0,1]=4 687 B22R3.5485654 Cc1ccc2[nH]c(c(c2c1)CCNCc3cncs3)C 270004a_100000076026_100000749870 [1,1,0,0,0,0|1,0,1]=4 688 B22R3.5485654 Cc1ccc2[nH]c(c(c2c1)CCNCc3nccs3)C 207a_100000076026_100000750902 [1,1,0,0,0,0|1,0,1]=4 689 B22R3.5485654 Cc1ccc2[nH]c(c(c2c1)CCNCc3nccs3)C 270004a_100000076026_100000750902 [1,1,0,0,0,0|1,0,1]=4 690 B22R3.5781976 Cc1[nH]c2ccccc2c1CCNCc3cccn3C 270004a_100000750322_100000211633 [1,1,0,0,0,0|1,0,1]=4 691 B22R3.5781976 Cc1[nH]c2ccccc2c1CCNCc3occc3Br 270004a_100000750322_100000756499 [1,1,0,0,0,0|0,1,1]=4 692 B22R3.5781976 Cc1[nH]c2ccccc2c1CCNCc3sccc3Br 207a_100000750322_100000766043 [1,1,0,0,0,0|0,0,1]=3 693 B22R3.5781976 Cc1[nH]c2ccccc2c1CCNCc3sccc3Br 270004a_100000750322_100000766043 [1,1,0,0,0,0|0,0,1]=3 694 B22R3.5781976 Cc1[nH]c2ccccc2c1CCNCc3sccc3Cl 207a_100000750322_100000722334 [1,1,0,0,0,0|0,0,1]=3 695 B22R3.5781976 Cc1[nH]c2ccccc2c1CCNCc3sccc3Cl 270004a_100000750322_100000722334 [1,1,0,0,0,0|0,0,1]=3 696 B22R3.5781976 Cc1ccoc1CNCCc2c([nH]c3c2cccc3)C 207a_100000750322_100000763527 [1,1,0,0,0,0|0,1,1]=4 697 B22R3.5781976 Cc1ccoc1CNCCc2c([nH]c3c2cccc3)C 270004a_100000750322_100000763527 [1,1,0,0,0,0|0,1,1]=4 698 B22R3.5781976 Cc1ccsc1CNCCc2c([nH]c3c2cccc3)C 207a_100000750322_100000210881 [1,1,0,0,0,0|0,0,1]=3 699 B22R3.5781976 Cc1ccsc1CNCCc2c([nH]c3c2cccc3)C 270004a_100000750322_100000210881 [1,1,0,0,0,0|0,0,1]=3 700 B22R3.5781976 Cc1ncsc1CNCCc2c([nH]c3c2cccc3)C 207a_100000750322_100000764165 [1,1,0,0,0,0|1,0,1]=4 701 B22R3.28899 Cc1[nH]c2ncccc2c1SC(C)C(=O)c3cccs3 62a_100011262360_100010174266 [0,1,0,0,1,0|2,0,0]=4 702 B22R3.28899 Cc1oc2ccccc2c1SC(C)C(=O)c3cccs3 62a_100011262360_200010236113 [0,1,0,0,1,0|2,0,0]=4 703 B22R3.28899 Cc1sc2ccccc2c1SC(C)C(=O)c3cccs3 62a_100010002616_100011262360 [0,1,0,0,1,0|2,0,0]=4 704 B22R3.28899 Cc1sc2ccccc2c1SC(C)C(=O)c3cccs3 62a_100011262360_100010002616 [0,1,0,0,1,0|2,0,0]=4 705 B22R3.257691 Cc1ccc2c(c1)NC(=O)C2=NNC(=O)c3cccs3 4a_100000184746_200000027159 [0,1,0,0,1,0|2,0,0]=4 706 B22R3.257691 O=C1Nc2cc(ccc2C1=NNC(=O)c3cccs3)Br 4a_100000184746_100000239657 [0,1,0,0,1,0|2,0,0]=4 707 B22R3.257691 O=C1Nc2cc(ccc2C1=NNC(=O)c3cccs3)Cl 4a_100000184746_100000741123 [0,1,0,0,1,0|2,0,0]=4 708 B22R3.257691 O=C1Nc2cc(ccc2C1=NNC(=O)c3cccs3)F 4a_100000184746_100000212334 [0,1,0,0,1,0|2,0,0]=4 709 B22R3.257691 O=C1Nc2cc(ccc2C1=NNC(=O)c3cccs3)I 4a_100000184746_100000049690 [0,1,0,0,1,0|2,0,0]=4 710 B22R3.609006 Cc1cccc2c1C(=NNC(=O)c3cccs3)C(=O)N2 4a_100000184746_100000076096 [0,1,0,0,1,0|2,0,0]=4 711 B22R3.609006 O=C1Nc2cccc(c2C1=NNC(=O)c3cccs3)Br 4a_100000184746_100000234798 [0,1,0,0,1,0|2,0,0]=4 712 B22R3.609006 O=C1Nc2cccc(c2C1=NNC(=O)c3cccs3)Cl 4a_100000184746_100000743965 [0,1,0,0,1,0|2,0,0]=4 713 B22R3.609006 O=C1Nc2cccc(c2C1=NNC(=O)c3cccs3)F 4a_100000184746_100000077294 [0,1,0,0,1,0|2,0,0]=4 714 B22R3.609006 O=C1Nc2cccc(c2C1=NNC(=O)c3cccs3)I 4a_100000184746_100000697038 [0,1,0,0,1,0|2,0,0]=4 715 B22R3.5316392 Cc1[nH]c2ncccc2c1SCC(=O)c3ccc(s3)Br 62a_100000185163_100010174266 [0,1,0,0,1,0|2,0,0]=4 716 B22R3.5316392 Cc1[nH]c2ncccc2c1SCC(=O)c3ccc(s3)Cl 62a_100000185135_100010174266 [0,1,0,0,1,0|2,0,0]=4 717 B22R3.5316392 Cc1ccc(s1)C(=O)CSc2c([nH]c3c2cccn3)C 62a_100011262362_100010174266 [0,1,0,0,1,0|2,0,0]=4 718 B22R3.5316392 Cc1ccc(s1)C(=O)CSc2c(oc3c2cccc3)C 62a_100011262362_200010236113 [0,1,0,0,1,0|2,0,0]=4 719 B22R3.5316392 Cc1ccc(s1)C(=O)CSc2c(sc3c2cccc3)C 62a_100010002616_100011262362 [0,1,0,0,1,0|2,0,0]=4 720 B22R3.5316392 Cc1ccc(s1)C(=O)CSc2c(sc3c2cccc3)C 62a_100011262362_100010002616 [0,1,0,0,1,0|2,0,0]=4 721 B22R3.5316392 Cc1ccc(s1)C(=O)NN=C2C(=O)Nc3c2cccc3 4a_100000189777_100000185742 [0,1,0,0,1,0|2,0,0]=4 722 B22R3.5316392 Cc1csc(c1)C(=O)NN=C2C(=O)Nc3c2cccc3 4a_100000143654_100000185742 [0,1,0,0,1,0|2,0,0]=4 723 B22R3.5316392 Cc1oc2ccccc2c1SCC(=O)c3ccc(s3)Br 62a_100000185163_200010236113 [0,1,0,0,1,0|2,0,0]=4 724 B22R3.5316392 Cc1oc2ccccc2c1SCC(=O)c3ccc(s3)Cl 62a_100000185135_200010236113 [0,1,0,0,1,0|2,0,0]=4 725 B22R3.5316392 Cc1sc2ccccc2c1SCC(=O)c3ccc(s3)Cl 62a_100000185135_100010002616 [0,1,0,0,1,0|2,0,0]=4 726 B22R3.5316392 Cc1sc2ccccc2c1SCC(=O)c3ccc(s3)Cl 62a_100010002616_100000185135 [0,1,0,0,1,0|2,0,0]=4 727 B22R3.5316392 O=C1Nc2ccccc2C1=NNC(=O)c3ccc(s3)Br 4a_100000180196_100000185742 [0,1,0,0,1,0|2,0,0]=4 728 B22R3.5316392 O=C1Nc2ccccc2C1=NNC(=O)c3ccc(s3)Cl 4a_100000189877_100000185742 [0,1,0,0,1,0|2,0,0]=4 729 B22R3.5486886 Cc1ccc2c(c1)C(=NNC(=O)c3cccs3)C(=O)N2 4a_100000184746_100000183581 [0,1,0,0,1,0|2,0,0]=4 730 B22R3.5486886 O=C1Nc2ccc(cc2C1=NNC(=O)c3cccs3)Br 4a_100000184746_100000186232 [0,1,0,0,1,0|2,0,0]=4 731 B22R3.5486886 O=C1Nc2ccc(cc2C1=NNC(=O)c3cccs3)Cl 4a_100000184746_100000183633 [0,1,0,0,1,0|2,0,0]=4 732 B22R3.5486886 O=C1Nc2ccc(cc2C1=NNC(=O)c3cccs3)F 4a_100000184746_100000182522 [0,1,0,0,1,0|2,0,0]=4 733 B22R3.5486886 O=C1Nc2ccc(cc2C1=NNC(=O)c3cccs3)I 4a_100000184746_100000024671 [0,1,0,0,1,0|2,0,0]=4 734 B22R3.6457350 Cc1[nH]c2ncccc2c1SCC(=O)c3sccc3Br 62a_100000740827_100010174266 [0,1,0,0,1,0|2,0,0]=4 735 B22R3.6457350 Cc1ccsc1C(=O)NN=C2C(=O)Nc3c2cccc3 4a_100000189776_100000185742 [0,1,0,0,1,0|2,0,0]=4 736 B22R3.6457350 Cc1oc2ccccc2c1SCC(=O)c3sccc3Br 62a_100000740827_200010236113 [0,1,0,0,1,0|2,0,0]=4 737 B22R3.6457350 O=C1Nc2ccccc2C1=NNC(=O)c3sccc3Cl 4a_100012021866_100000185742 [0,1,0,0,1,0|2,0,0]=4 738 B22R3.10332747 Cc1cccc2c1NC(=O)C2=NNC(=O)c3cccs3 4a_100000184746_100000183386 [0,1,0,0,1,0|2,0,0]=4 739 B22R3.10332747 O=C1Nc2c(cccc2C1=NNC(=O)c3cccs3)Cl 4a_100000184746_100000185868 [0,1,0,0,1,0|2,0,0]=4 740 B22R3.10332747 O=C1Nc2c(cccc2C1=NNC(=O)c3cccs3)I 4a_100000184746_100000743882 [0,1,0,0,1,0|2,0,0]=4 741 B22R3.20772883 CN1C(=O)C(=NNC(=O)c2cccs2)c3c1cccc3 4a_100000184746_100000183014 [0,1,0,0,1,0|2,0,0]=4 742 B22R3.20772883 O=C(NN=C1C(=O)N(c2c1cccc2)Cl)c3cccs3 4a_100000184746_200000101830 [0,1,0,0,1,0|2,0,0]=4 743 B24R3.52750 Cc1[nH]c2ccccc2c1CCNS(=O)(=O)c3ccccc3 270084a_100000750322_100000210345 [0,1,0,0,0,1|2,0,0]=4 744 B24R3.52750 Cc1[nH]c2ccccc2c1CCNS(=O)(=O)c3ccccc3 274078a_100000750322_100000210345 [0,1,0,0,0,1|2,0,0]=4 745 B24R3.52750 Cc1[nH]c2ccccc2c1CCNS(=O)(=O)c3ccccc3 40a_100000750322_100000032697 [0,1,0,0,0,1|2,0,0]=4 746 B24R3.52750 Cc1[nH]c2ccccc2c1CCNS(=O)(=O)c3ccccn3 270084a_100000750322_100016994956 [0,1,0,0,0,1|2,0,0]=4 747 B24R3.52750 Cc1[nH]c2ccccc2c1CCNS(=O)(=O)c3ccccn3 274078a_100000750322_100016994956 [0,1,0,0,0,1|2,0,0]=4 748 B24R3.52750 Cc1[nH]c2ccccc2c1CCNS(=O)(=O)c3ccccn3 40a_100000750322_100000070048 [0,1,0,0,0,1|2,0,0]=4 749 B24R3.52750 Cc1[nH]c2ccccc2c1CCNS(=O)(=O)c3cccnc3 270084a_100000750322_100000736704 [0,1,0,0,0,1|2,0,0]=4 750 B24R3.52750 Cc1[nH]c2ccccc2c1CCNS(=O)(=O)c3cccnc3 274078a_100000750322_100000736704 [0,1,0,0,0,1|2,0,0]=4 751 B24R3.2409267 Cc1[nH]c2ccc(cc2c1CCNC(=O)c3ccccc3)F 11a_100015200695_100000185807 [0,1,0,0,0,1|1,0,0]=3 752 B24R3.2409267 Cc1[nH]c2ccc(cc2c1CCNC(=O)c3ccccc3)F 240690a_100015200695_100000185807 [0,1,0,0,0,1|1,0,0]=3 753 B24R3.2409267 Cc1[nH]c2ccc(cc2c1CCNC(=O)c3ccccc3)F 527a_100015200695_100000185807 [0,1,0,0,0,1|1,0,0]=3 754 B24R3.2409267 Cc1ccc2[nH]c(c(c2c1)CCNC(=O)c3ccccc3)C 11a_100000076026_100000185807 [0,1,0,0,0,1|1,0,0]=3 755 B24R3.2409267 Cc1ccc2[nH]c(c(c2c1)CCNC(=O)c3ccccc3)C 240690a_100000076026_100000185807 [0,1,0,0,0,1|1,0,0]=3 756 B24R3.2409267 Cc1ccc2[nH]c(c(c2c1)CCNC(=O)c3ccccc3)C 527a_100000076026_100000185807 [0,1,0,0,0,1|1,0,0]=3 757 B24R3.11416660 Cc1[nH]c2ccccc2c1CCNC(=O)c3cccc(c3)Br 240690a_100000750322_100000210664 [0,1,0,0,0,1|1,0,0]=3 758 B24R3.11416660 Cc1[nH]c2ccccc2c1CCNC(=O)c3cccc(c3)Br 527a_100000750322_100000210664 [0,1,0,0,0,1|1,0,0]=3 759 B24R3.11416660 Cc1[nH]c2ccccc2c1CCNC(=O)c3cccc(c3)Cl 240690a_100000750322_100000210390 [0,1,0,0,0,1|1,0,0]=3 760 B24R3.11416660 Cc1[nH]c2ccccc2c1CCNC(=O)c3cccc(c3)Cl 527a_100000750322_100000210390 [0,1,0,0,0,1|1,0,0]=3 761 B24R3.11416660 Cc1[nH]c2ccccc2c1CCNC(=O)c3cccc(c3)F 240690a_100000750322_100000210950 [0,1,0,0,0,1|1,0,0]=3 762 B24R3.11416660 Cc1[nH]c2ccccc2c1CCNC(=O)c3cccc(c3)F 527a_100000750322_100000210950 [0,1,0,0,0,1|1,0,0]=3 763 B24R3.11416660 Cc1[nH]c2ccccc2c1CCNC(=O)c3cccc(c3)I 240690a_100000750322_100000184098 [0,1,0,0,0,1|1,0,0]=3 764 B24R3.11416660 Cc1[nH]c2ccccc2c1CCNC(=O)c3cccc(c3)I 527a_100000750322_100000184098 [0,1,0,0,0,1|1,0,0]=3 765 B24R3.11416660 Cc1[nH]c2ccccc2c1CCNC(=O)c3cccc(c3)O 240690a_100000750322_100000183914 [0,1,0,0,0,1|1,0,0]=3 766 B24R3.11416660 Cc1[nH]c2ccccc2c1CCNC(=O)c3cccc(c3)O 527a_100000750322_100000183914 [0,1,0,0,0,1|1,0,0]=3 767 B24R3.11416660 Cc1cccc(c1)C(=O)NCCc2c([nH]c3c2cccc3)C 240690a_100000750322_100000189346 [0,1,0,0,0,1|1,0,0]=3 768 B24R3.11416660 Cc1cccc(c1)C(=O)NCCc2c([nH]c3c2cccc3)C 527a_100000750322_100000189346 [0,1,0,0,0,1|1,0,0]=3 769 B24R3.23751396 CC1=C(SCCO1)C(=O)NCCc2c([nH]c3c2cccc3)C 527a_100000750322_100000022711 [0,1,0,0,0,1|0,0,2]=4 770 B24R3.23751396 Cc1[nH]c2ccccc2c1CCNC(=O)c3ccccc3Br 240690a_100000750322_100000188424 [0,1,0,0,0,1|1,0,0]=3 771 B24R3.23751396 Cc1[nH]c2ccccc2c1CCNC(=O)c3ccccc3Br 527a_100000750322_100000188424 [0,1,0,0,0,1|1,0,0]=3 772 B24R3.23751396 Cc1[nH]c2ccccc2c1CCNC(=O)c3ccccc3Cl 240690a_100000750322_100000185844 [0,1,0,0,0,1|1,0,0]=3 773 B24R3.23751396 Cc1[nH]c2ccccc2c1CCNC(=O)c3ccccc3Cl 527a_100000750322_100000185844 [0,1,0,0,0,1|1,0,0]=3 774 B24R3.23751396 Cc1[nH]c2ccccc2c1CCNC(=O)c3ccccc3F 240690a_100000750322_100000188656 [0,1,0,0,0,1|1,0,0]=3 775 B24R3.23751396 Cc1[nH]c2ccccc2c1CCNC(=O)c3ccccc3F 527a_100000750322_100000188656 [0,1,0,0,0,1|1,0,0]=3 776 B24R3.23751396 Cc1[nH]c2ccccc2c1CCNC(=O)c3ccccc3I 240690a_100000750322_100000187884 [0,1,0,0,0,1|1,0,0]=3 777 B24R3.23751396 Cc1[nH]c2ccccc2c1CCNC(=O)c3ccccc3I 527a_100000750322_100000187884 [0,1,0,0,0,1|1,0,0]=3 778 B24R3.23751396 Cc1[nH]c2ccccc2c1CCNC(=O)c3ccccc3O 240690a_100000750322_100015234032 [0,1,0,0,0,1|1,0,0]=3 779 B24R3.23751396 Cc1[nH]c2ccccc2c1CCNC(=O)c3ccccc3[O-] 240690a_100000750322_100009911694 [0,1,0,0,0,1|1,0,0]=3 780 B24R3.23751396 Cc1[nH]c2ccccc2c1CCNC(=O)c3ccccc3[O-] 527a_100000750322_100009911694 [0,1,0,0,0,1|1,0,0]=3 781 B24R3.23751396 Cc1ccccc1C(=O)NCCc2c([nH]c3c2cccc3)C 240690a_100000750322_100000212026 [0,1,0,0,0,1|1,0,0]=3 782 B24R3.23751396 Cc1ccccc1C(=O)NCCc2c([nH]c3c2cccc3)C 527a_100000750322_100000212026 [0,1,0,0,0,1|1,0,0]=3 783 B24R3.37778239 Cc1[nH]c2ccccc2c1CCNC(=O)c3ccc(cc3)Br 240690a_100000750322_100000185839 [0,1,0,0,0,1|1,0,0]=3 784 B24R3.37778239 Cc1[nH]c2ccccc2c1CCNC(=O)c3ccc(cc3)Br 527a_100000750322_100000185839 [0,1,0,0,0,1|1,0,0]=3 785 B24R3.37778239 Cc1[nH]c2ccccc2c1CCNC(=O)c3ccc(cc3)Cl 240690a_100000750322_100000210187 [0,1,0,0,0,1|1,0,0]=3 786 B24R3.37778239 Cc1[nH]c2ccccc2c1CCNC(=O)c3ccc(cc3)Cl 527a_100000750322_100000210187 [0,1,0,0,0,1|1,0,0]=3 787 B24R3.37778239 Cc1[nH]c2ccccc2c1CCNC(=O)c3ccc(cc3)F 240690a_100000750322_100000187176 [0,1,0,0,0,1|1,0,0]=3 788 B24R3.37778239 Cc1[nH]c2ccccc2c1CCNC(=O)c3ccc(cc3)F 527a_100000750322_100000187176 [0,1,0,0,0,1|1,0,0]=3 789 B24R3.37778239 Cc1[nH]c2ccccc2c1CCNC(=O)c3ccc(cc3)I 240690a_100000750322_100000187904 [0,1,0,0,0,1|1,0,0]=3 790 B24R3.37778239 Cc1[nH]c2ccccc2c1CCNC(=O)c3ccc(cc3)I 527a_100000750322_100000187904 [0,1,0,0,0,1|1,0,0]=3 791 B24R3.37778239 Cc1[nH]c2ccccc2c1CCNC(=O)c3ccc(cc3)O 240690a_100000750322_100000212099 [0,1,0,0,0,1|1,0,0]=3 792 B24R3.37778239 Cc1[nH]c2ccccc2c1CCNC(=O)c3ccc(cc3)O 527a_100000750322_100000212099 [0,1,0,0,0,1|1,0,0]=3 793 B24R3.37778239 Cc1ccc(cc1)C(=O)NCCc2c([nH]c3c2cccc3)C 240690a_100000750322_100000188618 [0,1,0,0,0,1|1,0,0]=3 794 B24R3.37778239 Cc1ccc(cc1)C(=O)NCCc2c([nH]c3c2cccc3)C 527a_100000750322_100000188618 [0,1,0,0,0,1|1,0,0]=3 795 B24R3.52762 Cc1[nH]c2ccccc2c1CC(=O)CCC(=O)c3cccs3 1458a_100000737320_100011290775 [0,1,0,0,0,1|1,0,0]=3 796 B24R3.52762 Cc1[nH]c2ccccc2c1CC(=O)NNC(=O)c3ccc[nH]3 22a_100000018271_100000737320 [0,1,0,0,0,1|1,0,1]=4 797 B24R3.52762 Cc1[nH]c2ccccc2c1CC(=O)NNC(=O)c3ccco3 22a_100000185077_100000737320 [0,1,0,0,0,1|0,1,1]=4 798 B24R3.52762 Cc1[nH]c2ccccc2c1CC(=O)NNC(=O)c3cccs3 22a_100000184746_100000737320 [0,1,0,0,0,1|0,0,1]=3 799 B24R3.52762 Cc1[nH]c2ccccc2c1CC(=O)NNC(=O)c3cncs3 22a_200000241815_100000737320 [0,1,0,0,0,1|1,0,1]=4 800 B24R3.52762 Cc1[nH]c2ccccc2c1CC(=O)NNC(=O)c3nccs3 22a_100000077877_100000737320 [0,1,0,0,0,1|1,0,1]=4 801 B24R3.53129 Cc1sc2ccccc2c1SCC(=O)NC(=O)c3cccs3 62a_100010002616_100000016191 [0,1,0,0,0,1|1,0,1]=4 802 B24R3.3205309 Cc1[nH]c2ccccc2c1C(=O)CSCC(=O)c3cccs3 62a_100000211436_100000182688 [0,1,0,0,0,1|1,0,1]=4 803 B24R3.109919 CCc1nc2ccccc2n1CCNC(=O)Cc3cccs3 11a_100000749130_100000210189 [0,1,0,0,0,1|1,0,1]=4 804 B24R3.109919 CCc1nc2ccccc2n1CCNC(=O)Cc3cccs3 1626a_100000749130_100000210189 [0,1,0,0,0,1|1,0,1]=4 805 B24R3.109919 CCc1nc2ccccc2n1CCNC(=O)Cc3cccs3 240690a_100000749130_100000210189 [0,1,0,0,0,1|1,0,1]=4 806 B24R3.23768337 Cc1[nH]c2c(cccc2c1C=NNC(=O)Cc3cccs3)C 4a_100000189772_200011934716 [0,1,0,0,0,1|1,0,1]=4 807 B24R3.24455829 Cc1[nH]c2ccccc2c1CCNC(=O)Cc3nccn3C 240690a_100000750322_200015194843 [0,1,0,0,0,1|2,0,0]=4 808 B24R3.24455829 Cc1[nH]c2ccccc2c1CCNC(=O)Cn3nccc3C 240690a_100000750322_100000759144 [0,1,0,0,0,1|2,0,0]=4 809 B24R3.24455829 Cc1[nH]c2ccccc2c1CCNC(=O)Cn3nccc3C 527a_100000750322_100000759144 [0,1,0,0,0,1|2,0,0]=4 810 B24R3.115396560 Cc1[nH]c2ccccc2c1CCNC(=O)Cc3cc(cs3)Br 240690a_100000750322_100011542370 [0,1,0,0,0,1|0,0,0]=2 811 B24R3.115396560 Cc1[nH]c2ccccc2c1CCNC(=O)Cc3ccc(s3)Cl 240690a_100000750322_100000238644 [0,1,0,0,0,1|0,0,0]=2 812 B24R3.115396560 Cc1[nH]c2ccccc2c1CCNC(=O)Cc3cn(cn3)C 240690a_100000750322_100011512828 [0,1,0,0,0,1|2,0,0]=4 813 B24R3.115396560 Cc1[nH]c2ccccc2c1CCNC(=O)Cc3cn(cn3)C 527a_100000750322_100011512828 [0,1,0,0,0,1|2,0,0]=4 814 B24R3.115396560 Cc1[nH]c2ccccc2c1CCNC(=O)Cn3cc(cn3)Br 240690a_100000750322_100000238729 [0,1,0,0,0,1|2,0,0]=4 815 B24R3.115396560 Cc1[nH]c2ccccc2c1CCNC(=O)Cn3cc(cn3)Br 527a_100000750322_100000238729 [0,1,0,0,0,1|2,0,0]=4 816 B24R3.115396560 Cc1[nH]c2ccccc2c1CCNC(=O)Cn3cc(cn3)Cl 240690a_100000750322_100000759256 [0,1,0,0,0,1|2,0,0]=4 817 B24R3.115396560 Cc1[nH]c2ccccc2c1CCNC(=O)Cn3cc(cn3)Cl 527a_100000750322_100000759256 [0,1,0,0,0,1|2,0,0]=4 818 B24R3.115396560 Cc1[nH]c2ccccc2c1CCNC(=O)Cn3cc(cn3)I 240690a_100000750322_100012072407 [0,1,0,0,0,1|2,0,0]=4 819 B24R3.115396560 Cc1[nH]c2ccccc2c1CCNC(=O)Cn3cc(cn3)I 527a_100000750322_100012072407 [0,1,0,0,0,1|2,0,0]=4 820 B24R3.115396560 Cc1cc(on1)CC(=O)NCCc2c([nH]c3c2cccc3)C 240690a_100000750322_100000037866 [0,1,0,0,0,1|1,1,0]=4 821 B24R3.115396560 Cc1ccn(n1)CC(=O)NCCc2c([nH]c3c2cccc3)C 240690a_100000750322_100000238720 [0,1,0,0,0,1|2,0,0]=4 822 B24R3.115396560 Cc1ccn(n1)CC(=O)NCCc2c([nH]c3c2cccc3)C 527a_100000750322_100000238720 [0,1,0,0,0,1|2,0,0]=4 823 B24R3.115396560 Cc1cnn(c1)CC(=O)NCCc2c([nH]c3c2cccc3)C 240690a_100000750322_100000743463 [0,1,0,0,0,1|2,0,0]=4 824 B24R3.115396560 Cc1cnn(c1)CC(=O)NCCc2c([nH]c3c2cccc3)C 527a_100000750322_100000743463 [0,1,0,0,0,1|2,0,0]=4 825 B24R3.115396560 Cc1csc(n1)CC(=O)NCCc2c([nH]c3c2cccc3)C 240690a_100000750322_100000734950 [0,1,0,0,0,1|1,0,0]=3 826 B24R3.115396560 Cc1nc(cs1)CC(=O)NCCc2c([nH]c3c2cccc3)C 240690a_100000750322_100000184407 [0,1,0,0,0,1|2,0,0]=4 827 B24R3.115396560 Cc1nc(cs1)CC(=O)NCCc2c([nH]c3c2cccc3)C 527a_100000750322_100000184407 [0,1,0,0,0,1|2,0,0]=4 828 B24R3.115396560 Cc1nc2ccccc2n1CCNC(=O)Cc3cc(cs3)Br 11a_200000204690_100011542370 [0,1,0,0,0,1|1,0,1]=4 829 B24R3.115396560 Cc1nc2ccccc2n1CCNC(=O)Cc3cc(cs3)Br 1626a_200000204690_100011542370 [0,1,0,0,0,1|1,0,1]=4 830 B24R3.115396560 Cc1nc2ccccc2n1CCNC(=O)Cc3cc(cs3)Br 240690a_200000204690_100011542370 [0,1,0,0,0,1|1,0,1]=4 831 B24R3.115396560 Cc1nc2ccccc2n1CCNC(=O)Cc3ccc(s3)Br 11a_200000204690_100000238643 [0,1,0,0,0,1|1,0,1]=4 832 B24R3.115396560 Cc1nc2ccccc2n1CCNC(=O)Cc3ccc(s3)Br 1626a_200000204690_100000238643 [0,1,0,0,0,1|1,0,1]=4 833 B24R3.115396560 Cc1nc2ccccc2n1CCNC(=O)Cc3ccc(s3)Cl 11a_200000204690_100000238644 [0,1,0,0,0,1|1,0,1]=4 834 B24R3.115396560 Cc1nc2ccccc2n1CCNC(=O)Cc3ccc(s3)Cl 1626a_200000204690_100000238644 [0,1,0,0,0,1|1,0,1]=4 835 B24R3.115396560 Cc1nc2ccccc2n1CCNC(=O)Cc3ccc(s3)Cl 240690a_200000204690_100000238644 [0,1,0,0,0,1|1,0,1]=4 836 B24R3.115396560 O=C(Cc1cc(cs1)Br)NCCC2C(=O)Nc3c2cccc3 240690a_100000737811_100011542370 [0,1,0,0,0,1|1,0,1]=4 837 B24R3.115396560 O=C(Cc1cc(cs1)Br)NCCn2c(=O)[nH]c3c2cccc3 11a_203549771432_100011542370 [0,1,0,0,0,1|2,0,0]=4 838 B24R3.115396560 O=C(Cc1cc(cs1)Br)NCCn2c(=O)[nH]c3c2cccc3 240690a_203549771432_100011542370 [0,1,0,0,0,1|2,0,0]=4 839 B24R3.115396560 O=C(Cc1ccc(s1)Br)NCCn2c(=O)[nH]c3c2cccc3 11a_203549771432_100000238643 [0,1,0,0,0,1|2,0,0]=4 840 B24R3.115396560 O=C(Cc1ccc(s1)Cl)NCCC2C(=O)Nc3c2cccc3 240690a_100000737811_100000238644 [0,1,0,0,0,1|1,0,1]=4 841 B24R3.115396560 O=C(Cc1ccc(s1)Cl)NCCn2c(=O)[nH]c3c2cccc3 11a_203549771432_100000238644 [0,1,0,0,0,1|2,0,0]=4 842 B24R3.115396560 O=C(Cc1ccc(s1)Cl)NCCn2c(=O)[nH]c3c2cccc3 240690a_203549771432_100000238644 [0,1,0,0,0,1|2,0,0]=4 843 B24R3.118750410 Cc1[nH]c2ccc(cc2c1C=NNC(=O)Cc3cccs3)Cl 4a_100000189772_100000692368 [0,1,0,0,0,1|1,0,1]=4 844 B24R3.118750410 Cc1[nH]c2ccc(cc2c1C=NNC(=O)Cc3cccs3)F 4a_100000189772_100000244797 [0,1,0,0,0,1|1,0,1]=4 845 B24R3.118750410 Cc1[nH]c2ccc(cc2c1CCNC(=O)Cc3c[nH]cn3)F 240690a_100015200695_100015291406 [0,1,0,0,0,1|2,0,0]=4 846 B24R3.118750410 Cc1[nH]c2ccc(cc2c1CCNC(=O)Cc3ccc[nH]3)F 11a_100015200695_100000238377 [0,1,0,0,0,1|1,0,0]=3 847 B24R3.118750410 Cc1[nH]c2ccc(cc2c1CCNC(=O)Cc3ccc[nH]3)F 240690a_100015200695_100000238377 [0,1,0,0,0,1|1,0,0]=3 848 B24R3.118750410 Cc1[nH]c2ccc(cc2c1CCNC(=O)Cc3ccc[nH]3)F 527a_100015200695_100000238377 [0,1,0,0,0,1|1,0,0]=3 849 B24R3.118750410 Cc1[nH]c2ccc(cc2c1CCNC(=O)Cc3ccco3)F 11a_100015200695_100011217309 [0,1,0,0,0,1|0,1,0]=3 850 B24R3.118750410 Cc1[nH]c2ccc(cc2c1CCNC(=O)Cc3ccco3)F 527a_100015200695_100011217309 [0,1,0,0,0,1|0,1,0]=3 851 B24R3.118750410 Cc1[nH]c2ccc(cc2c1CCNC(=O)Cc3cccs3)F 11a_100015200695_100000210189 [0,1,0,0,0,1|0,0,0]=2 852 B24R3.118750410 Cc1[nH]c2ccc(cc2c1CCNC(=O)Cc3cccs3)F 240690a_100015200695_100000210189 [0,1,0,0,0,1|0,0,0]=2 853 B24R3.118750410 Cc1[nH]c2ccc(cc2c1CCNC(=O)Cc3ccn[nH]3)F 11a_100015200695_100000752941 [0,1,0,0,0,1|2,0,0]=4 854 B24R3.118750410 Cc1[nH]c2ccc(cc2c1CCNC(=O)Cc3ccn[nH]3)F 240690a_100015200695_100000752941 [0,1,0,0,0,1|2,0,0]=4 855 B24R3.118750410 Cc1[nH]c2ccc(cc2c1CCNC(=O)Cc3ccn[nH]3)F 527a_100015200695_100000752941 [0,1,0,0,0,1|2,0,0]=4 856 B24R3.118750410 Cc1[nH]c2ccc(cc2c1CCNC(=O)Cc3ccoc3)F 11a_100015200695_100000684892 [0,1,0,0,0,1|2,0,0]=4 857 B24R3.118750410 Cc1[nH]c2ccc(cc2c1CCNC(=O)Cc3ccoc3)F 240690a_100015200695_100000684892 [0,1,0,0,0,1|2,0,0]=4 858 B24R3.118750410 Cc1[nH]c2ccc(cc2c1CCNC(=O)Cc3ccoc3)F 527a_100015200695_100000684892 [0,1,0,0,0,1|2,0,0]=4 859 B24R3.118750410 Cc1[nH]c2ccc(cc2c1CCNC(=O)Cc3ccsc3)F 11a_100015200695_100000184062 [0,1,0,0,0,1|2,0,0]=4 860 B24R3.118750410 Cc1[nH]c2ccc(cc2c1CCNC(=O)Cc3ccsc3)F 240690a_100015200695_100000184062 [0,1,0,0,0,1|2,0,0]=4 861 B24R3.118750410 Cc1[nH]c2ccc(cc2c1CCNC(=O)Cc3ccsc3)F 527a_100015200695_100000184062 [0,1,0,0,0,1|2,0,0]=4 862 B24R3.118750410 Cc1[nH]c2ccc(cc2c1CCNC(=O)Cc3cscn3)F 11a_100015200695_100011438297 [0,1,0,0,0,1|2,0,0]=4 863 B24R3.118750410 Cc1[nH]c2ccc(cc2c1CCNC(=O)Cc3cscn3)F 240690a_100015200695_100011438297 [0,1,0,0,0,1|2,0,0]=4 864 B24R3.118750410 Cc1[nH]c2ccc(cc2c1CCNC(=O)Cc3cscn3)F 527a_100015200695_100011438297 [0,1,0,0,0,1|2,0,0]=4 865 B24R3.118750410 Cc1[nH]c2ccc(cc2c1CCNC(=O)Cn3cccc3)F 11a_100015200695_100011196272 [0,1,0,0,0,1|2,0,0]=4 866 B24R3.118750410 Cc1[nH]c2ccc(cc2c1CCNC(=O)Cn3cccc3)F 527a_100015200695_100011196272 [0,1,0,0,0,1|2,0,0]=4 867 B24R3.118750410 Cc1[nH]c2ccc(cc2c1CCNC(=O)Cn3cccn3)F 11a_100015200695_100000233772 [0,1,0,0,0,1|2,0,0]=4 868 B24R3.118750410 Cc1[nH]c2ccc(cc2c1CCNC(=O)Cn3cccn3)F 240690a_100015200695_100000233772 [0,1,0,0,0,1|2,0,0]=4 869 B24R3.118750410 Cc1[nH]c2ccc(cc2c1CCNC(=O)Cn3cccn3)F 527a_100015200695_100000233772 [0,1,0,0,0,1|2,0,0]=4 870 B24R3.118750410 Cc1ccc2[nH]c(c(c2c1)CCNC(=O)Cc3c[nH]cn3)C 240690a_100000076026_100015291406 [0,1,0,0,0,1|2,0,0]=4 871 B24R3.118750410 Cc1ccc2[nH]c(c(c2c1)CCNC(=O)Cc3ccc[nH]3)C 11a_100000076026_100000238377 [0,1,0,0,0,1|1,0,0]=3 872 B24R3.118750410 Cc1ccc2[nH]c(c(c2c1)CCNC(=O)Cc3ccc[nH]3)C 240690a_100000076026_100000238377 [0,1,0,0,0,1|1,0,0]=3 873 B24R3.118750410 Cc1ccc2[nH]c(c(c2c1)CCNC(=O)Cc3ccc[nH]3)C 527a_100000076026_100000238377 [0,1,0,0,0,1|1,0,0]=3 874 B24R3.118750410 Cc1ccc2[nH]c(c(c2c1)CCNC(=O)Cc3ccco3)C 11a_100000076026_100011217309 [0,1,0,0,0,1|0,1,0]=3 875 B24R3.118750410 Cc1ccc2[nH]c(c(c2c1)CCNC(=O)Cc3ccco3)C 527a_100000076026_100011217309 [0,1,0,0,0,1|0,1,0]=3 876 B24R3.118750410 Cc1ccc2[nH]c(c(c2c1)CCNC(=O)Cc3cccs3)C 11a_100000076026_100000210189 [0,1,0,0,0,1|0,0,0]=2 877 B24R3.118750410 Cc1ccc2[nH]c(c(c2c1)CCNC(=O)Cc3cccs3)C 240690a_100000076026_100000210189 [0,1,0,0,0,1|0,0,0]=2 878 B24R3.118750410 Cc1ccc2[nH]c(c(c2c1)CCNC(=O)Cc3ccn[nH]3)C 11a_100000076026_100000752941 [0,1,0,0,0,1|2,0,0]=4 879 B24R3.118750410 Cc1ccc2[nH]c(c(c2c1)CCNC(=O)Cc3ccn[nH]3)C 240690a_100000076026_100000752941 [0,1,0,0,0,1|2,0,0]=4 880 B24R3.118750410 Cc1ccc2[nH]c(c(c2c1)CCNC(=O)Cc3ccn[nH]3)C 527a_100000076026_100000752941 [0,1,0,0,0,1|2,0,0]=4 881 B24R3.118750410 Cc1ccc2[nH]c(c(c2c1)CCNC(=O)Cc3ccoc3)C 11a_100000076026_100000684892 [0,1,0,0,0,1|2,0,0]=4 882 B24R3.118750410 Cc1ccc2[nH]c(c(c2c1)CCNC(=O)Cc3ccoc3)C 240690a_100000076026_100000684892 [0,1,0,0,0,1|2,0,0]=4 883 B24R3.118750410 Cc1ccc2[nH]c(c(c2c1)CCNC(=O)Cc3ccoc3)C 527a_100000076026_100000684892 [0,1,0,0,0,1|2,0,0]=4 884 B24R3.118750410 Cc1ccc2[nH]c(c(c2c1)CCNC(=O)Cc3ccsc3)C 11a_100000076026_100000184062 [0,1,0,0,0,1|2,0,0]=4 885 B24R3.118750410 Cc1ccc2[nH]c(c(c2c1)CCNC(=O)Cc3ccsc3)C 240690a_100000076026_100000184062 [0,1,0,0,0,1|2,0,0]=4 886 B24R3.118750410 Cc1ccc2[nH]c(c(c2c1)CCNC(=O)Cc3ccsc3)C 527a_100000076026_100000184062 [0,1,0,0,0,1|2,0,0]=4 887 B24R3.118750410 Cc1ccc2[nH]c(c(c2c1)CCNC(=O)Cc3cscn3)C 11a_100000076026_100011438297 [0,1,0,0,0,1|2,0,0]=4 888 B24R3.118750410 Cc1ccc2[nH]c(c(c2c1)CCNC(=O)Cc3cscn3)C 240690a_100000076026_100011438297 [0,1,0,0,0,1|2,0,0]=4 889 B24R3.118750410 Cc1ccc2[nH]c(c(c2c1)CCNC(=O)Cc3cscn3)C 527a_100000076026_100011438297 [0,1,0,0,0,1|2,0,0]=4 890 B24R3.118750410 Cc1ccc2[nH]c(c(c2c1)CCNC(=O)Cn3cccc3)C 11a_100000076026_100011196272 [0,1,0,0,0,1|2,0,0]=4 891 B24R3.118750410 Cc1ccc2[nH]c(c(c2c1)CCNC(=O)Cn3cccc3)C 527a_100000076026_100011196272 [0,1,0,0,0,1|2,0,0]=4 892 B24R3.118750410 Cc1ccc2[nH]c(c(c2c1)CCNC(=O)Cn3cccn3)C 11a_100000076026_100000233772 [0,1,0,0,0,1|2,0,0]=4 893 B24R3.118750410 Cc1ccc2[nH]c(c(c2c1)CCNC(=O)Cn3cccn3)C 240690a_100000076026_100000233772 [0,1,0,0,0,1|2,0,0]=4 894 B24R3.118750410 Cc1ccc2[nH]c(c(c2c1)CCNC(=O)Cn3cccn3)C 527a_100000076026_100000233772 [0,1,0,0,0,1|2,0,0]=4 895 B24R3.1191471852 Cc1c(c2ccccc2n1C)C=NNC(=O)Cc3cccs3 4a_100000189772_100000009060 [0,1,0,0,0,1|1,0,1]=4 896 B24R3.3205496 Cc1[nH]c2ccccc2c1CC(=O)NS(=O)(=O)c3cccs3 2740a_100000164514_100000737320 [0,2,0,0,0,0|1,0,1]=4 897 B24R3.11485673 Cc1[nH]c2ccc(cc2c1CCNS(=O)(=O)c3ccco3)F 270084a_100015200695_200000702926 [0,2,0,0,0,0|1,1,0]=4 898 B24R3.11485673 Cc1[nH]c2ccc(cc2c1CCNS(=O)(=O)c3ccco3)F 274078a_100015200695_200000702926 [0,2,0,0,0,0|1,1,0]=4 899 B24R3.11485673 Cc1[nH]c2ccc(cc2c1CCNS(=O)(=O)c3cccs3)F 270084a_100015200695_100000205146 [0,2,0,0,0,0|1,0,0]=3 900 B24R3.11485673 Cc1[nH]c2ccc(cc2c1CCNS(=O)(=O)c3cccs3)F 274078a_100015200695_100000205146 [0,2,0,0,0,0|1,0,0]=3 901 B24R3.11485673 Cc1[nH]c2ccc(cc2c1CCNS(=O)(=O)c3cccs3)F 40a_100015200695_200000102146 [0,2,0,0,0,0|1,0,0]=3 902 B24R3.11485673 Cc1ccc2[nH]c(c(c2c1)CCNS(=O)(=O)c3ccco3)C 270084a_100000076026_200000702926 [0,2,0,0,0,0|1,1,0]=4 903 B24R3.11485673 Cc1ccc2[nH]c(c(c2c1)CCNS(=O)(=O)c3ccco3)C 274078a_100000076026_200000702926 [0,2,0,0,0,0|1,1,0]=4 904 B24R3.11485673 Cc1ccc2[nH]c(c(c2c1)CCNS(=O)(=O)c3cccs3)C 270084a_100000076026_100000205146 [0,2,0,0,0,0|1,0,0]=3 905 B24R3.11485673 Cc1ccc2[nH]c(c(c2c1)CCNS(=O)(=O)c3cccs3)C 274078a_100000076026_100000205146 [0,2,0,0,0,0|1,0,0]=3 906 B24R3.11485673 Cc1ccc2[nH]c(c(c2c1)CCNS(=O)(=O)c3cccs3)C 40a_100000076026_200000102146 [0,2,0,0,0,0|1,0,0]=3 907 B24R3.115249955 Cc1[nH]c2ccccc2c1CCNS(=O)(=O)c3ccc(s3)Br 270084a_100000750322_100000184974 [0,2,0,0,0,0|1,0,0]=3 908 B24R3.115249955 Cc1[nH]c2ccccc2c1CCNS(=O)(=O)c3ccc(s3)Br 274078a_100000750322_100000184974 [0,2,0,0,0,0|1,0,0]=3 909 B24R3.115249955 Cc1[nH]c2ccccc2c1CCNS(=O)(=O)c3ccc(s3)Br 40a_100000750322_200010307234 [0,2,0,0,0,0|1,0,0]=3 910 B24R3.115249955 Cc1[nH]c2ccccc2c1CCNS(=O)(=O)c3ccc(s3)Cl 270084a_100000750322_100000211601 [0,2,0,0,0,0|1,0,0]=3 911 B24R3.115249955 Cc1[nH]c2ccccc2c1CCNS(=O)(=O)c3ccc(s3)Cl 274078a_100000750322_100000211601 [0,2,0,0,0,0|1,0,0]=3 912 B24R3.115249955 Cc1cc(sn1)S(=O)(=O)NCCc2c([nH]c3c2cccc3)C 270084a_100000750322_100000720884 [0,2,0,0,0,0|2,0,0]=4 913 B24R3.115249955 Cc1cc(sn1)S(=O)(=O)NCCc2c([nH]c3c2cccc3)C 274078a_100000750322_100000720884 [0,2,0,0,0,0|2,0,0]=4 914 B24R3.115249955 Cc1ccc(s1)S(=O)(=O)NCCc2c([nH]c3c2cccc3)C 270084a_100000750322_100000229961 [0,2,0,0,0,0|1,0,0]=3 915 B24R3.115249955 Cc1ccc(s1)S(=O)(=O)NCCc2c([nH]c3c2cccc3)C 274078a_100000750322_100000229961 [0,2,0,0,0,0|1,0,0]=3 916 B24R3.138779477 Cc1[nH]c2ccccc2c1CCNS(=O)(=O)c3sccc3Br 270084a_100000750322_100000739646 [0,2,0,0,0,0|1,0,0]=3 917 B24R3.138779477 Cc1[nH]c2ccccc2c1CCNS(=O)(=O)c3sccc3Br 274078a_100000750322_100000739646 [0,2,0,0,0,0|1,0,0]=3 918 B24R3.138779477 Cc1ccsc1S(=O)(=O)NCCc2c([nH]c3c2cccc3)C 270084a_100000750322_100000760287 [0,2,0,0,0,0|1,0,0]=3 919 B24R3.138779477 Cc1ccsc1S(=O)(=O)NCCc2c([nH]c3c2cccc3)C 274078a_100000750322_100000760287 [0,2,0,0,0,0|1,0,0]=3 920 B24R3.138779477 Cc1ncsc1S(=O)(=O)NCCc2c([nH]c3c2cccc3)C 270084a_100000750322_100000094910 [0,2,0,0,0,0|2,0,0]=4 921 B24R3.138779477 Cc1ncsc1S(=O)(=O)NCCc2c([nH]c3c2cccc3)C 274078a_100000750322_100000094910 [0,2,0,0,0,0|2,0,0]=4 922 B24R3.147386 Cc1[nH]c2ccccc2c1CC(=O)C(C)C(=O)c3cccs3 1458a_100000737320_100011262360 [0,2,0,0,0,0|1,0,1]=4 923 B24R3.10931900 Cc1[nH]c2ccccc2c1CC(=O)CC(=O)c3ccc(s3)Br 1458a_100000737320_100000185163 [0,2,0,0,0,0|1,0,1]=4 924 B24R3.10931900 Cc1[nH]c2ccccc2c1CC(=O)CC(=O)c3ccc(s3)Cl 1458a_100000737320_100000185135 [0,2,0,0,0,0|1,0,1]=4 925 B24R3.10931900 Cc1ccc(s1)C(=O)CC(=O)Cc2c([nH]c3c2cccc3)C 1458a_100000737320_100011262362 [0,2,0,0,0,0|1,0,1]=4 926 B24R3.14188780 Cc1[nH]c2ccccc2c1CC(=O)CC(=O)c3sccc3Br 1458a_100000737320_100000740827 [0,2,0,0,0,0|1,0,1]=4 927 B24R3.118779462 Cc1[nH]c2ccc(cc2c1CC(=O)CC(=O)c3cccs3)Br 1458a_100000738758_100000211436 [0,2,0,0,0,0|1,0,1]=4 928 B24R3.118779462 Cc1[nH]c2ccc(cc2c1CC(=O)CC(=O)c3cccs3)Cl 1458a_100016600606_100000211436 [0,2,0,0,0,0|1,0,1]=4 929 B24R3.118779462 Cc1[nH]c2ccc(cc2c1CC(=O)CC(=O)c3cccs3)F 1458a_100000044558_100000211436 [0,2,0,0,0,0|1,0,1]=4 930 B24R3.30636286 CCCC(NCCc1c([nH]c2c1cccc2)C)c3cccs3 269862a_100000750322_100011218182 [0,2,0,0,0,0|1,0,1]=4 931 B24R3.420182806 CCC(NCCc1c([nH]c2c1cc(cc2)C)C)c3cccs3 269862a_100000076026_100000211688 [0,2,0,0,0,0|1,0,1]=4 932 B24R3.420182806 CCC(NCCc1c([nH]c2c1cc(cc2)F)C)c3cccs3 269862a_100015200695_100000211688 [0,2,0,0,0,0|1,0,1]=4 933 B24R3.420183879 CCC(NCCc1c([nH]c2c1cccc2)C)c3ccc(s3)Br 269862a_100000750322_200011203577 [0,2,0,0,0,0|1,0,1]=4 934 B24R3.420183879 CCC(NCCc1c([nH]c2c1cccc2)C)c3ccc(s3)C 269862a_100000750322_100011203523 [0,2,0,0,0,0|1,0,1]=4 935 B24R3.420183879 CCC(NCCc1c([nH]c2c1cccc2)C)c3ccc(s3)Cl 269862a_100000750322_100000238488 [0,2,0,0,0,0|1,0,1]=4 936 B24R3.6069328 CCc1ccc(s1)C(C)NCCc2c([nH]c3c2cccc3)C 269862a_100000750322_100000198524 [0,2,0,0,0,0|1,0,1]=4 937 B24R3.10995419 Cc1[nH]c2c(cccc2c1C=NNC(=O)c3ccc(s3)Br)C 4a_100000180196_200011934716 [0,2,0,0,0,0|1,0,1]=4 938 B24R3.10995419 Cc1[nH]c2c(cccc2c1C=NNC(=O)c3ccc(s3)Cl)C 4a_100000189877_200011934716 [0,2,0,0,0,0|1,0,1]=4 939 B24R3.10995419 Cc1ccc(s1)C(=O)NN=Cc2c([nH]c3c2cccc3C)C 4a_100000189777_200011934716 [0,2,0,0,0,0|1,0,1]=4 940 B24R3.10995419 Cc1csc(c1)C(=O)NN=Cc2c([nH]c3c2cccc3C)C 4a_100000143654_200011934716 [0,2,0,0,0,0|1,0,1]=4 941 B24R3.10995422 Cc1c(c2ccccc2n1C)C=NNC(=O)c3ccc(s3)Br 4a_100000180196_100000009060 [0,2,0,0,0,0|1,0,1]=4 942 B24R3.10995422 Cc1c(c2ccccc2n1C)C=NNC(=O)c3ccc(s3)Cl 4a_100000189877_100000009060 [0,2,0,0,0,0|1,0,1]=4 943 B24R3.10995422 Cc1ccc(s1)C(=O)NN=Cc2c(n(c3c2cccc3)C)C 4a_100000189777_100000009060 [0,2,0,0,0,0|1,0,1]=4 944 B24R3.10995422 Cc1csc(c1)C(=O)NN=Cc2c(n(c3c2cccc3)C)C 4a_100000143654_100000009060 [0,2,0,0,0,0|1,0,1]=4 945 B24R3.24415936 Cc1[nH]c2ccccc2c1C=NNC(=O)c3cc(c(s3)Br)Br 4a_100000189973_100000186307 [0,2,0,0,0,0|1,0,1]=4 946 B24R3.24415936 Cc1[nH]c2ccccc2c1CCNC(C)c3cc(c(s3)Br)Cl 269862a_100000750322_200012360051 [0,2,0,0,0,0|1,0,1]=4 947 B24R3.24415936 Cc1[nH]c2ccccc2c1CCNC(C)c3cc(c(s3)Cl)Cl 269862a_100000750322_100000074699 [0,2,0,0,0,0|1,0,1]=4 948 B24R3.115402401 Cc1[nH]c2ccc(cc2c1C=NNC(=O)c3ccc(s3)Br)Cl 4a_100000180196_100000692368 [0,2,0,0,0,0|1,0,1]=4 949 B24R3.115402401 Cc1[nH]c2ccc(cc2c1C=NNC(=O)c3ccc(s3)Br)F 4a_100000180196_100000244797 [0,2,0,0,0,0|1,0,1]=4 950 B24R3.115402401 Cc1[nH]c2ccc(cc2c1C=NNC(=O)c3ccc(s3)Cl)Cl 4a_100000189877_100000692368 [0,2,0,0,0,0|1,0,1]=4 951 B24R3.115402401 Cc1[nH]c2ccc(cc2c1C=NNC(=O)c3ccc(s3)Cl)F 4a_100000189877_100000244797 [0,2,0,0,0,0|1,0,1]=4 952 B24R3.115402401 Cc1[nH]c2ccc(cc2c1CCNC(C)c3cc(cs3)Br)F 269862a_100015200695_100000718618 [0,2,0,0,0,0|1,0,1]=4 953 B24R3.115402401 Cc1[nH]c2ccc(cc2c1CCNC(C)c3cc(cs3)Cl)F 269862a_100015200695_100000061699 [0,2,0,0,0,0|1,0,1]=4 954 B24R3.115402401 Cc1[nH]c2ccc(cc2c1CCNC(C)c3ccc(s3)Br)F 269862a_100015200695_100000183331 [0,2,0,0,0,0|1,0,1]=4 955 B24R3.115402401 Cc1[nH]c2ccc(cc2c1CCNC(C)c3ccc(s3)Cl)F 269862a_100015200695_100000182421 [0,2,0,0,0,0|1,0,1]=4 956 B24R3.115402401 Cc1[nH]c2ccc(cc2c1CCNC(C)c3ccc(s3)I)F 269862a_100015200695_200000034408 [0,2,0,0,0,0|1,0,1]=4 957 B24R3.115402401 Cc1ccc(s1)C(=O)NN=Cc2c([nH]c3c2cc(cc3)Cl)C 4a_100000189777_100000692368 [0,2,0,0,0,0|1,0,1]=4 958 B24R3.115402401 Cc1ccc(s1)C(=O)NN=Cc2c([nH]c3c2cc(cc3)F)C 4a_100000189777_100000244797 [0,2,0,0,0,0|1,0,1]=4 959 B24R3.115402401 Cc1ccc(s1)C(C)NCCc2c([nH]c3c2cc(cc3)F)C 269862a_100015200695_100000195387 [0,2,0,0,0,0|1,0,1]=4 960 B24R3.115402401 Cc1ccc2[nH]c(c(c2c1)CCNC(C)c3cc(cs3)Br)C 269862a_100000076026_100000718618 [0,2,0,0,0,0|1,0,1]=4 961 B24R3.115402401 Cc1ccc2[nH]c(c(c2c1)CCNC(C)c3cc(cs3)Cl)C 269862a_100000076026_100000061699 [0,2,0,0,0,0|1,0,1]=4 962 B24R3.115402401 Cc1ccc2[nH]c(c(c2c1)CCNC(C)c3ccc(s3)Br)C 269862a_100000076026_100000183331 [0,2,0,0,0,0|1,0,1]=4 963 B24R3.115402401 Cc1ccc2[nH]c(c(c2c1)CCNC(C)c3ccc(s3)C)C 269862a_100000076026_100000195387 [0,2,0,0,0,0|1,0,1]=4 964 B24R3.115402401 Cc1ccc2[nH]c(c(c2c1)CCNC(C)c3ccc(s3)Cl)C 269862a_100000076026_100000182421 [0,2,0,0,0,0|1,0,1]=4 965 B24R3.115402401 Cc1ccc2[nH]c(c(c2c1)CCNC(C)c3ccc(s3)I)C 269862a_100000076026_200000034408 [0,2,0,0,0,0|1,0,1]=4 966 B24R3.115402401 Cc1csc(c1)C(=O)NN=Cc2c([nH]c3c2cc(cc3)Cl)C 4a_100000143654_100000692368 [0,2,0,0,0,0|1,0,1]=4 967 B24R3.115402401 Cc1csc(c1)C(=O)NN=Cc2c([nH]c3c2cc(cc3)F)C 4a_100000143654_100000244797 [0,2,0,0,0,0|1,0,1]=4 968 B24R3.115402401 Cc1csc(c1)C(C)NCCc2c([nH]c3c2cc(cc3)C)C 269862a_100000076026_100000034720 [0,2,0,0,0,0|1,0,1]=4 969 B24R3.115402401 Cc1csc(c1)C(C)NCCc2c([nH]c3c2cc(cc3)F)C 269862a_100015200695_100000034720 [0,2,0,0,0,0|1,0,1]=4 970 B24R3.1495654439 Cc1csc(c1Cl)C(=O)NN=Cc2c([nH]c3c2cccc3)C 4a_100011219041_100000186307 [0,2,0,0,0,0|1,0,1]=4 971 B24R3.6612302 COc1ccc2[nH]c(c(c2c1)C=NNC(=O)c3cccs3)C 4a_100000184746_100011998116 [0,2,0,0,0,0|1,0,1]=4 972 B24R3.11485799 Cc1[nH]c2ccc(cc2c1C=NNC(=O)c3sccc3Cl)Cl 4a_100012021866_100000692368 [0,2,0,0,0,0|1,0,1]=4 973 B24R3.11485799 Cc1[nH]c2ccc(cc2c1C=NNC(=O)c3sccc3Cl)F 4a_100012021866_100000244797 [0,2,0,0,0,0|1,0,1]=4 974 B24R3.11485799 Cc1[nH]c2ccc(cc2c1CCNC(C)c3sccc3Br)F 269862a_100015200695_100000738688 [0,2,0,0,0,0|1,0,1]=4 975 B24R3.11485799 Cc1ccc2[nH]c(c(c2c1)CCNC(C)c3sccc3Br)C 269862a_100000076026_100000738688 [0,2,0,0,0,0|1,0,1]=4 976 B24R3.11485799 Cc1ccsc1C(=O)NN=Cc2c([nH]c3c2cc(cc3)Cl)C 4a_100000189776_100000692368 [0,2,0,0,0,0|1,0,1]=4 977 B24R3.11485799 Cc1ccsc1C(=O)NN=Cc2c([nH]c3c2cc(cc3)F)C 4a_100000189776_100000244797 [0,2,0,0,0,0|1,0,1]=4 978 B24R3.26687300 Cc1[nH]c2c(cc(cc2c1CCNC(C)c3cccs3)F)F 269862a_100015184701_100000185736 [0,2,0,0,0,0|1,0,1]=4 979 B24R3.225784006 Cc1c(c2cc(ccc2n1C)O)C=NNC(=O)c3cccs3 4a_100000184746_100010621882 [0,2,0,0,0,0|1,0,1]=4 980 B24R3.14229213 Cc1[nH]c2c(cccc2c1C=NNC(=O)c3sccc3Cl)C 4a_100012021866_200011934716 [0,2,0,0,0,0|1,0,1]=4 981 B24R3.14229213 Cc1ccsc1C(=O)NN=Cc2c([nH]c3c2cccc3C)C 4a_100000189776_200011934716 [0,2,0,0,0,0|1,0,1]=4 982 B24R3.14229216 Cc1c(c2ccccc2n1C)C=NNC(=O)c3sccc3Cl 4a_100012021866_100000009060 [0,2,0,0,0,0|1,0,1]=4 983 B24R3.14229216 Cc1ccsc1C(=O)NN=Cc2c(n(c3c2cccc3)C)C 4a_100000189776_100000009060 [0,2,0,0,0,0|1,0,1]=4 984 B22R3.1426936 C/C=C/C=CC(=O)N1CCc2c([nH]c3c2cccc3)C1 11a_100000694026_100000185730 [0,0,1,1,0,0|1,0,0]=3 985 B22R3.1426936 C/C=C/C=CC(=O)N1CCc2c([nH]c3c2cccc3)C1 240690a_100000694026_100000185730 [0,0,1,1,0,0|1,0,0]=3 986 B22R3.1426936 C/C=C/C=CC(=O)N1CCc2c(oc3c2cccc3)C1 11a_200016992036_100000185730 [0,0,1,1,0,0|2,0,0]=4 987 B22R3.1426936 C/C=C/C=CC(=O)N1CCc2c(oc3c2cccc3)C1 1626a_200016992036_100000185730 [0,0,1,1,0,0|2,0,0]=4 988 B22R3.1426936 C/C=C/C=CC(=O)N1CCc2c(oc3c2cccc3)C1 240690a_200016992036_100000185730 [0,0,1,1,0,0|2,0,0]=4 989 B22R3.1426936 C=CCSCC(=O)N1CCc2c([nH]c3c2cccc3)C1 11a_100000694026_100000230395 [0,0,1,1,0,0|0,0,2]=4 990 B22R3.1426936 C=CCSCC(=O)N1CCc2c([nH]c3c2cccc3)C1 240690a_100000694026_100000230395 [0,0,1,1,0,0|0,0,2]=4 991 B22R3.1426936 C=CCSCC(=O)N1CCc2c([nH]c3c2cccc3)C1 527a_100000694026_100000230395 [0,0,1,1,0,0|0,0,2]=4 992 B22R3.1430221 C/C=C/C=CC(=O)NC1Cc2[nH]c3ccccc3c2C1 1626a_100009852730_100000185730 [0,0,1,1,0,0|1,0,0]=3 993 B22R3.1430221 C/C=C/C=CC(=O)NC1Cc2[nH]c3ccccc3c2C1 240690a_100009852730_100000185730 [0,0,1,1,0,0|1,0,0]=3 994 B22R3.1430221 C=CCSCC(=O)NC1Cc2[nH]c3ccccc3c2C1 1626a_100009852730_100000230395 [0,0,1,1,0,0|0,0,2]=4 995 B22R3.1430221 C=CCSCC(=O)NC1Cc2[nH]c3ccccc3c2C1 240690a_100009852730_100000230395 [0,0,1,1,0,0|0,0,2]=4 996 B22R3.1430221 C=CCSCC(=O)NC1Cc2[nH]c3ccccc3c2C1 527a_100009852730_100000230395 [0,0,1,1,0,0|0,0,2]=4 997 B22R3.11547148 Cc1[nH]c2ccccc2c1CCNc3cccc(n3)F 27a_100000750322_100009815982 [0,0,1,1,0,0|2,0,0]=4 998 B22R3.5665271 Cc1[nH]c2ccccc2c1CCNc3ncccc3Br 27a_100000750322_100000696092 [0,0,1,1,0,0|2,0,0]=4 999 B22R4.1466560 c1ccc2c3c([nH]c2c1)CC(C3)NCc4cncs4 207a_100009852730_100000749870 [1,0,0,1,0,0|1,0,1]=4 1000 B22R4.1466560 c1ccc2c3c([nH]c2c1)CC(C3)NCc4cncs4 2230a_100009852730_100015185245 [1,0,0,1,0,0|1,0,1]=4 1001 B22R4.1466560 c1ccc2c3c([nH]c2c1)CC(C3)NCc4cncs4 270004a_100009852730_100000749870 [1,0,0,1,0,0|1,0,1]=4 1002 B22R4.1466560 c1ccc2c3c([nH]c2c1)CC(C3)NCc4nccs4 207a_100009852730_100000750902 [1,0,0,1,0,0|1,0,1]=4 1003 B22R4.1466560 c1ccc2c3c([nH]c2c1)CC(C3)NCc4nccs4 2230a_100009852730_100015184050 [1,0,0,1,0,0|1,0,1]=4 1004 B22R4.1466560 c1ccc2c3c([nH]c2c1)CC(C3)NCc4nccs4 270004a_100009852730_100000750902 [1,0,0,1,0,0|1,0,1]=4 1005 B22R4.1466560 c1coc(c1)CNC2Cc3[nH]c4ccccc4c3C2 207a_100009852730_100000186105 [1,0,0,1,0,0|0,1,1]=4 1006 B22R4.1466560 c1coc(c1)CNC2Cc3[nH]c4ccccc4c3C2 270004a_100009852730_100000186105 [1,0,0,1,0,0|0,1,1]=4 1007 B22R4.1466560 c1csc(c1)CNC2Cc3[nH]c4ccccc4c3C2 207a_100009852730_100000209959 [1,0,0,1,0,0|0,0,1]=3 1008 B22R4.1466560 c1csc(c1)CNC2Cc3[nH]c4ccccc4c3C2 270004a_100009852730_100000209959 [1,0,0,1,0,0|0,0,1]=3 1009 B22R4.5842370 c1ccc2c3c([nH]c2c1)CN(CC3)Cc4cncs4 2230a_100000694026_100015185245 [1,0,0,1,0,0|1,0,1]=4 1010 B22R4.5842370 c1ccc2c3c([nH]c2c1)CN(CC3)Cc4cncs4 269982a_100000694026_100015185245 [1,0,0,1,0,0|1,0,1]=4 1011 B22R4.5842370 c1ccc2c3c([nH]c2c1)CN(CC3)Cc4cncs4 270004a_100000694026_100000749870 [1,0,0,1,0,0|1,0,1]=4 1012 B22R4.5842370 c1ccc2c3c([nH]c2c1)CN(CC3)Cc4nccs4 2230a_100000694026_100015184050 [1,0,0,1,0,0|1,0,1]=4 1013 B22R4.5842370 c1ccc2c3c([nH]c2c1)CN(CC3)Cc4nccs4 269982a_100000694026_100015184050 [1,0,0,1,0,0|1,0,1]=4 1014 B22R4.5842370 c1ccc2c3c([nH]c2c1)CN(CC3)Cc4nccs4 270004a_100000694026_100000750902 [1,0,0,1,0,0|1,0,1]=4 1015 B22R4.5842370 c1coc(c1)CN2CCc3c([nH]c4c3cccc4)C2 270004a_100000694026_100000186105 [1,0,0,1,0,0|0,1,1]=4 1016 B22R4.5842370 c1csc(c1)CN2CCc3c([nH]c4c3cccc4)C2 270004a_100000694026_100000209959 [1,0,0,1,0,0|0,0,1]=3 1017 B22R4.5842370 c1csc(c1)CN2CCc3c(oc4c3cccc4)C2 270004a_200016992036_100000209959 [1,0,0,1,0,0|1,0,1]=4 1018 B24R4.7253152 O=C(c1ccccc1)N2CCc3c([nH]c4c3cccc4)C2 11a_100000694026_100000185807 [0,0,0,1,0,1|1,0,0]=3 1019 B24R4.7253152 O=C(c1ccccc1)N2CCc3c([nH]c4c3cccc4)C2 240690a_100000694026_100000185807 [0,0,0,1,0,1|1,0,0]=3 1020 B24R4.7253152 O=C(c1ccccc1)N2CCc3c([nH]c4c3cccc4)C2 527a_100000694026_100000185807 [0,0,0,1,0,1|1,0,0]=3 1021 B24R4.7253152 O=C(c1ccccc1)N2CCc3c(oc4c3cccc4)C2 11a_200016992036_100000185807 [0,0,0,1,0,1|2,0,0]=4 1022 B24R4.7253152 O=C(c1ccccc1)N2CCc3c(oc4c3cccc4)C2 1626a_200016992036_100000185807 [0,0,0,1,0,1|2,0,0]=4 1023 B24R4.7253152 O=C(c1ccccc1)N2CCc3c(oc4c3cccc4)C2 240690a_200016992036_100000185807 [0,0,0,1,0,1|2,0,0]=4 1024 B24R4.7253152 O=C(c1ccccc1)N2CCc3c(oc4c3cccc4)C2 527a_200016992036_100000185807 [0,0,0,1,0,1|2,0,0]=4 1025 B24R4.42113615 O=C(NC1Cc2[nH]c3ccccc3c2C1)c4ccccc4 1626a_100009852730_100000185807 [0,0,0,1,0,1|1,0,0]=3 1026 B24R4.42113615 O=C(NC1Cc2[nH]c3ccccc3c2C1)c4ccccc4 240690a_100009852730_100000185807 [0,0,0,1,0,1|1,0,0]=3 1027 B24R4.42113615 O=C(NC1Cc2[nH]c3ccccc3c2C1)c4ccccc4 527a_100009852730_100000185807 [0,0,0,1,0,1|1,0,0]=3 1028 B24R4.42104755 O=C(CN1CCc2c([nH]c3c2cccc3)C1)c4ccc[nH]4 269982a_100000694026_200011262396 [0,0,0,1,0,1|1,0,0]=3 1029 B24R4.42104755 O=C(CN1CCc2c([nH]c3c2cccc3)C1)c4ccco4 269982a_100000694026_100000211439 [0,0,0,1,0,1|0,1,0]=3 1030 B24R4.42104755 O=C(CN1CCc2c([nH]c3c2cccc3)C1)c4cccs4 2230a_100000694026_100000211436 [0,0,0,1,0,1|0,0,0]=2 1031 B24R4.42104755 O=C(CN1CCc2c([nH]c3c2cccc3)C1)c4cccs4 269982a_100000694026_100000211436 [0,0,0,1,0,1|0,0,0]=2 1032 B24R4.42104755 O=C(CN1CCc2c([nH]c3c2cccc3)C1)c4ccsc4 2230a_100000694026_100011219462 [0,0,0,1,0,1|2,0,0]=4 1033 B24R4.42104755 O=C(CN1CCc2c([nH]c3c2cccc3)C1)c4ccsc4 269982a_100000694026_100011219462 [0,0,0,1,0,1|2,0,0]=4 1034 B24R4.42104755 O=C(CN1CCc2c([nH]c3c2cccc3)C1)c4nccs4 269982a_100000694026_100000718653 [0,0,0,1,0,1|1,0,0]=3 1035 B24R4.42104755 O=C(CN1CCc2c([nH]c3c2cccc3)C1)n4cccn4 2230a_100000694026_100000077511 [0,0,0,1,0,1|2,0,0]=4 1036 B24R4.42104755 O=C(CN1CCc2c([nH]c3c2cccc3)C1)n4cccn4 269982a_100000694026_100000077511 [0,0,0,1,0,1|2,0,0]=4 1037 B24R4.42104755 O=C(CN1CCc2c(oc3c2cccc3)C1)c4ccc[nH]4 269982a_200016992036_200011262396 [0,0,0,1,0,1|2,0,0]=4 1038 B24R4.42104755 O=C(CN1CCc2c(oc3c2cccc3)C1)c4ccco4 269982a_200016992036_100000211439 [0,0,0,1,0,1|1,1,0]=4 1039 B24R4.42104755 O=C(CN1CCc2c(oc3c2cccc3)C1)c4cccs4 2230a_200016992036_100000211436 [0,0,0,1,0,1|1,0,0]=3 1040 B24R4.42104755 O=C(CN1CCc2c(oc3c2cccc3)C1)c4cccs4 269982a_200016992036_100000211436 [0,0,0,1,0,1|1,0,0]=3 1041 B24R4.42104755 O=C(CN1CCc2c(oc3c2cccc3)C1)c4nccs4 269982a_200016992036_100000718653 [0,0,0,1,0,1|2,0,0]=4 1042 B24R4.42140124 O=C(CNC1Cc2[nH]c3ccccc3c2C1)c4cccs4 2230a_100009852730_100000211436 [0,0,0,1,0,1|0,0,0]=2 1043 B24R4.42140124 O=C(CNC1Cc2[nH]c3ccccc3c2C1)c4ccsc4 2230a_100009852730_100011219462 [0,0,0,1,0,1|2,0,0]=4 1044 B24R4.42140124 O=C(CNC1Cc2[nH]c3ccccc3c2C1)n4cccn4 2230a_100009852730_100000077511 [0,0,0,1,0,1|2,0,0]=4 1045 B24R4.42106915 O=C(Cc1c[nH]cn1)N2CCc3c([nH]c4c3cccc4)C2 240690a_100000694026_100015291406 [0,0,0,1,0,1|2,0,0]=4 1046 B24R4.42106915 O=C(Cc1ccc[nH]1)N2CCc3c([nH]c4c3cccc4)C2 11a_100000694026_100000238377 [0,0,0,1,0,1|1,0,0]=3 1047 B24R4.42106915 O=C(Cc1ccc[nH]1)N2CCc3c([nH]c4c3cccc4)C2 240690a_100000694026_100000238377 [0,0,0,1,0,1|1,0,0]=3 1048 B24R4.42106915 O=C(Cc1ccc[nH]1)N2CCc3c([nH]c4c3cccc4)C2 527a_100000694026_100000238377 [0,0,0,1,0,1|1,0,0]=3 1049 B24R4.42106915 O=C(Cc1ccc[nH]1)N2CCc3c(oc4c3cccc4)C2 11a_200016992036_100000238377 [0,0,0,1,0,1|2,0,0]=4 1050 B24R4.42106915 O=C(Cc1ccc[nH]1)N2CCc3c(oc4c3cccc4)C2 240690a_200016992036_100000238377 [0,0,0,1,0,1|2,0,0]=4 1051 B24R4.42106915 O=C(Cc1ccc[nH]1)N2CCc3c(oc4c3cccc4)C2 527a_200016992036_100000238377 [0,0,0,1,0,1|2,0,0]=4 1052 B24R4.42106915 O=C(Cc1ccco1)N2CCc3c([nH]c4c3cccc4)C2 11a_100000694026_100011217309 [0,0,0,1,0,1|0,1,0]=3 1053 B24R4.42106915 O=C(Cc1ccco1)N2CCc3c([nH]c4c3cccc4)C2 527a_100000694026_100011217309 [0,0,0,1,0,1|0,1,0]=3 1054 B24R4.42106915 O=C(Cc1ccco1)N2CCc3c(oc4c3cccc4)C2 11a_200016992036_100011217309 [0,0,0,1,0,1|1,1,0]=4 1055 B24R4.42106915 O=C(Cc1ccco1)N2CCc3c(oc4c3cccc4)C2 527a_200016992036_100011217309 [0,0,0,1,0,1|1,1,0]=4 1056 B24R4.42106915 O=C(Cc1cccs1)N2CCc3c([nH]c4c3cccc4)C2 11a_100000694026_100000210189 [0,0,0,1,0,1|0,0,0]=2 1057 B24R4.42106915 O=C(Cc1cccs1)N2CCc3c([nH]c4c3cccc4)C2 240690a_100000694026_100000210189 [0,0,0,1,0,1|0,0,0]=2 1058 B24R4.42106915 O=C(Cc1cccs1)N2CCc3c(oc4c3cccc4)C2 11a_200016992036_100000210189 [0,0,0,1,0,1|1,0,0]=3 1059 B24R4.42106915 O=C(Cc1cccs1)N2CCc3c(oc4c3cccc4)C2 1626a_200016992036_100000210189 [0,0,0,1,0,1|1,0,0]=3 1060 B24R4.42106915 O=C(Cc1cccs1)N2CCc3c(oc4c3cccc4)C2 240690a_200016992036_100000210189 [0,0,0,1,0,1|1,0,0]=3 1061 B24R4.42106915 O=C(Cc1ccn[nH]1)N2CCc3c([nH]c4c3cccc4)C2 11a_100000694026_100000752941 [0,0,0,1,0,1|2,0,0]=4 1062 B24R4.42106915 O=C(Cc1ccn[nH]1)N2CCc3c([nH]c4c3cccc4)C2 240690a_100000694026_100000752941 [0,0,0,1,0,1|2,0,0]=4 1063 B24R4.42106915 O=C(Cc1ccn[nH]1)N2CCc3c([nH]c4c3cccc4)C2 527a_100000694026_100000752941 [0,0,0,1,0,1|2,0,0]=4 1064 B24R4.42106915 O=C(Cc1ccoc1)N2CCc3c([nH]c4c3cccc4)C2 11a_100000694026_100000684892 [0,0,0,1,0,1|2,0,0]=4 1065 B24R4.42106915 O=C(Cc1ccoc1)N2CCc3c([nH]c4c3cccc4)C2 240690a_100000694026_100000684892 [0,0,0,1,0,1|2,0,0]=4 1066 B24R4.42106915 O=C(Cc1ccoc1)N2CCc3c([nH]c4c3cccc4)C2 527a_100000694026_100000684892 [0,0,0,1,0,1|2,0,0]=4 1067 B24R4.42106915 O=C(Cc1ccsc1)N2CCc3c([nH]c4c3cccc4)C2 11a_100000694026_100000184062 [0,0,0,1,0,1|2,0,0]=4 1068 B24R4.42106915 O=C(Cc1ccsc1)N2CCc3c([nH]c4c3cccc4)C2 240690a_100000694026_100000184062 [0,0,0,1,0,1|2,0,0]=4 1069 B24R4.42106915 O=C(Cc1ccsc1)N2CCc3c([nH]c4c3cccc4)C2 527a_100000694026_100000184062 [0,0,0,1,0,1|2,0,0]=4 1070 B24R4.42106915 O=C(Cc1cscn1)N2CCc3c([nH]c4c3cccc4)C2 11a_100000694026_100011438297 [0,0,0,1,0,1|2,0,0]=4 1071 B24R4.42106915 O=C(Cc1cscn1)N2CCc3c([nH]c4c3cccc4)C2 240690a_100000694026_100011438297 [0,0,0,1,0,1|2,0,0]=4 1072 B24R4.42106915 O=C(Cc1cscn1)N2CCc3c([nH]c4c3cccc4)C2 527a_100000694026_100011438297 [0,0,0,1,0,1|2,0,0]=4 1073 B24R4.42106915 O=C(Cn1cccc1)N2CCc3c([nH]c4c3cccc4)C2 11a_100000694026_100011196272 [0,0,0,1,0,1|2,0,0]=4 1074 B24R4.42106915 O=C(Cn1cccc1)N2CCc3c([nH]c4c3cccc4)C2 527a_100000694026_100011196272 [0,0,0,1,0,1|2,0,0]=4 1075 B24R4.42106915 O=C(Cn1cccn1)N2CCc3c([nH]c4c3cccc4)C2 11a_100000694026_100000233772 [0,0,0,1,0,1|2,0,0]=4 1076 B24R4.42106915 O=C(Cn1cccn1)N2CCc3c([nH]c4c3cccc4)C2 240690a_100000694026_100000233772 [0,0,0,1,0,1|2,0,0]=4 1077 B24R4.42106915 O=C(Cn1cccn1)N2CCc3c([nH]c4c3cccc4)C2 527a_100000694026_100000233772 [0,0,0,1,0,1|2,0,0]=4 1078 B24R4.42132037 O=C(Cc1c[nH]cn1)NC2Cc3[nH]c4ccccc4c3C2 240690a_100009852730_100015291406 [0,0,0,1,0,1|2,0,0]=4 1079 B24R4.42132037 O=C(Cc1ccc[nH]1)NC2Cc3[nH]c4ccccc4c3C2 240690a_100009852730_100000238377 [0,0,0,1,0,1|1,0,0]=3 1080 B24R4.42132037 O=C(Cc1ccc[nH]1)NC2Cc3[nH]c4ccccc4c3C2 527a_100009852730_100000238377 [0,0,0,1,0,1|1,0,0]=3 1081 B24R4.42132037 O=C(Cc1ccco1)NC2Cc3[nH]c4ccccc4c3C2 527a_100009852730_100011217309 [0,0,0,1,0,1|0,1,0]=3 1082 B24R4.42132037 O=C(Cc1cccs1)NC2Cc3[nH]c4ccccc4c3C2 1626a_100009852730_100000210189 [0,0,0,1,0,1|0,0,0]=2 1083 B24R4.42132037 O=C(Cc1cccs1)NC2Cc3[nH]c4ccccc4c3C2 240690a_100009852730_100000210189 [0,0,0,1,0,1|0,0,0]=2 1084 B24R4.42132037 O=C(Cc1ccn[nH]1)NC2Cc3[nH]c4ccccc4c3C2 1626a_100009852730_100000752941 [0,0,0,1,0,1|2,0,0]=4 1085 B24R4.42132037 O=C(Cc1ccn[nH]1)NC2Cc3[nH]c4ccccc4c3C2 240690a_100009852730_100000752941 [0,0,0,1,0,1|2,0,0]=4 1086 B24R4.42132037 O=C(Cc1ccn[nH]1)NC2Cc3[nH]c4ccccc4c3C2 527a_100009852730_100000752941 [0,0,0,1,0,1|2,0,0]=4 1087 B24R4.42132037 O=C(Cc1ccoc1)NC2Cc3[nH]c4ccccc4c3C2 1626a_100009852730_100000684892 [0,0,0,1,0,1|2,0,0]=4 1088 B24R4.42132037 O=C(Cc1ccoc1)NC2Cc3[nH]c4ccccc4c3C2 240690a_100009852730_100000684892 [0,0,0,1,0,1|2,0,0]=4 1089 B24R4.42132037 O=C(Cc1ccoc1)NC2Cc3[nH]c4ccccc4c3C2 527a_100009852730_100000684892 [0,0,0,1,0,1|2,0,0]=4 1090 B24R4.42132037 O=C(Cc1ccsc1)NC2Cc3[nH]c4ccccc4c3C2 1626a_100009852730_100000184062 [0,0,0,1,0,1|2,0,0]=4 1091 B24R4.42132037 O=C(Cc1ccsc1)NC2Cc3[nH]c4ccccc4c3C2 240690a_100009852730_100000184062 [0,0,0,1,0,1|2,0,0]=4 1092 B24R4.42132037 O=C(Cc1ccsc1)NC2Cc3[nH]c4ccccc4c3C2 527a_100009852730_100000184062 [0,0,0,1,0,1|2,0,0]=4 1093 B24R4.42132037 O=C(Cc1cscn1)NC2Cc3[nH]c4ccccc4c3C2 1626a_100009852730_100011438297 [0,0,0,1,0,1|2,0,0]=4 1094 B24R4.42132037 O=C(Cc1cscn1)NC2Cc3[nH]c4ccccc4c3C2 240690a_100009852730_100011438297 [0,0,0,1,0,1|2,0,0]=4 1095 B24R4.42132037 O=C(Cc1cscn1)NC2Cc3[nH]c4ccccc4c3C2 527a_100009852730_100011438297 [0,0,0,1,0,1|2,0,0]=4 1096 B24R4.42132037 O=C(Cn1cccc1)NC2Cc3[nH]c4ccccc4c3C2 1626a_100009852730_100011196272 [0,0,0,1,0,1|2,0,0]=4 1097 B24R4.42132037 O=C(Cn1cccc1)NC2Cc3[nH]c4ccccc4c3C2 527a_100009852730_100011196272 [0,0,0,1,0,1|2,0,0]=4 1098 B24R4.42132037 O=C(Cn1cccn1)NC2Cc3[nH]c4ccccc4c3C2 1626a_100009852730_100000233772 [0,0,0,1,0,1|2,0,0]=4 1099 B24R4.42132037 O=C(Cn1cccn1)NC2Cc3[nH]c4ccccc4c3C2 240690a_100009852730_100000233772 [0,0,0,1,0,1|2,0,0]=4 1100 B24R4.42132037 O=C(Cn1cccn1)NC2Cc3[nH]c4ccccc4c3C2 527a_100009852730_100000233772 [0,0,0,1,0,1|2,0,0]=4 1101 B24R4.151268806 O=S(=O)(c1ccco1)N2CCc3c([nH]c4c3cccc4)C2 270084a_100000694026_200000702926 [0,1,0,1,0,0|1,1,0]=4 1102 B24R4.151268806 O=S(=O)(c1ccco1)N2CCc3c([nH]c4c3cccc4)C2 274078a_100000694026_200000702926 [0,1,0,1,0,0|1,1,0]=4 1103 B24R4.151268806 O=S(=O)(c1cccs1)N2CCc3c([nH]c4c3cccc4)C2 270084a_100000694026_100000205146 [0,1,0,1,0,0|1,0,0]=3 1104 B24R4.151268806 O=S(=O)(c1cccs1)N2CCc3c([nH]c4c3cccc4)C2 274078a_100000694026_100000205146 [0,1,0,1,0,0|1,0,0]=3 1105 B24R4.151268806 O=S(=O)(c1cccs1)N2CCc3c([nH]c4c3cccc4)C2 40a_100000694026_200000102146 [0,1,0,1,0,0|1,0,0]=3 1106 B24R4.151268806 O=S(=O)(c1cccs1)N2CCc3c(oc4c3cccc4)C2 270084a_200016992036_100000205146 [0,1,0,1,0,0|2,0,0]=4 1107 B24R4.151268806 O=S(=O)(c1cccs1)N2CCc3c(oc4c3cccc4)C2 274078a_200016992036_100000205146 [0,1,0,1,0,0|2,0,0]=4 1108 B24R4.151268806 O=S(=O)(c1cccs1)N2CCc3c(oc4c3cccc4)C2 40a_200016992036_200000102146 [0,1,0,1,0,0|2,0,0]=4 1109 B24R4.151279123 O=S(=O)(NC1Cc2[nH]c3ccccc3c2C1)c4ccco4 270084a_100009852730_200000702926 [0,1,0,1,0,0|1,1,0]=4 1110 B24R4.151279123 O=S(=O)(NC1Cc2[nH]c3ccccc3c2C1)c4ccco4 274078a_100009852730_200000702926 [0,1,0,1,0,0|1,1,0]=4 1111 B24R4.151279123 O=S(=O)(NC1Cc2[nH]c3ccccc3c2C1)c4cccs4 270084a_100009852730_100000205146 [0,1,0,1,0,0|1,0,0]=3 1112 B24R4.151279123 O=S(=O)(NC1Cc2[nH]c3ccccc3c2C1)c4cccs4 274078a_100009852730_100000205146 [0,1,0,1,0,0|1,0,0]=3 1113 B24R4.151279123 O=S(=O)(NC1Cc2[nH]c3ccccc3c2C1)c4cccs4 40a_100009852730_200000102146 [0,1,0,1,0,0|1,0,0]=3 1114 B24R4.4107908 O=C(NN=C1CCc2c1c3c([nH]2)cccc3)c4cccs4 4a_100000184746_200012187033 [0,1,0,1,0,0|1,0,1]=4 1115 B24R4.42104961 CC(NC1CCc2[nH]c3ccccc3c2C1)c4cccs4 270004a_100000703493_200102525245 [0,1,0,1,0,0|1,0,1]=4 1116 B24R4.42104961 CC(N[C@@H]1CCc2[nH]c3ccccc3c2C1)c4cccs4 269862a_100015190494_100000185736 [0,1,0,1,0,0|1,0,1]=4 1117 B24R4.42104961 O=C(CN1CCc2[nH]c3ccccc3c2C1)c4cccs4 2230a_100000239914_100000211436 [0,1,0,1,0,0|2,0,0]=4 1118 B24R4.42104961 O=C(CN1CCc2[nH]c3ccccc3c2C1)c4cccs4 269982a_100000239914_100000211436 [0,1,0,1,0,0|2,0,0]=4 1119 B24R4.35145132 Cc1[nH]c2ccccc2c1CCNC3CCc4c3scc4 269862a_100000750322_100000080523 [0,1,0,1,0,0|1,0,1]=4 1120 B24R4.43657739 CCC(NC1Cc2[nH]c3ccccc3c2C1)c4cccs4 269862a_100009852730_100000211688 [0,1,0,1,0,0|1,0,1]=4 1121 B24R4.13549361 CC(NC1Cc2[nH]c3ccccc3c2C1)c4cc(cs4)Br 269862a_100009852730_100000718618 [0,1,0,1,0,0|1,0,1]=4 1122 B24R4.13549361 CC(NC1Cc2[nH]c3ccccc3c2C1)c4cc(cs4)Cl 269862a_100009852730_100000061699 [0,1,0,1,0,0|1,0,1]=4 1123 B24R4.13549361 CC(NC1Cc2[nH]c3ccccc3c2C1)c4ccc(s4)Br 269862a_100009852730_100000183331 [0,1,0,1,0,0|1,0,1]=4 1124 B24R4.13549361 CC(NC1Cc2[nH]c3ccccc3c2C1)c4ccc(s4)Cl 269862a_100009852730_100000182421 [0,1,0,1,0,0|1,0,1]=4 1125 B24R4.13549361 CC(NC1Cc2[nH]c3ccccc3c2C1)c4ccc(s4)I 269862a_100009852730_200000034408 [0,1,0,1,0,0|1,0,1]=4 1126 B24R4.13549361 Cc1ccc(s1)C(C)NC2Cc3[nH]c4ccccc4c3C2 269862a_100009852730_100000195387 [0,1,0,1,0,0|1,0,1]=4 1127 B24R4.13549361 Cc1csc(c1)C(C)NC2Cc3[nH]c4ccccc4c3C2 269862a_100009852730_100000034720 [0,1,0,1,0,0|1,0,1]=4 1128 B24R4.15158242 CC(NC1Cc2[nH]c3ccccc3c2C1)c4sccc4Br 269862a_100009852730_100000738688 [0,1,0,1,0,0|1,0,1]=4 1129 B20R2.11600 C/C=C/c1ccccc1OCCC(=O)c2cccs2 7a_200000189419_100011290775 [0,0,1,0,1,0|2,0,0]=4 1130 B20R2.11600 CCNc1ccccc1OCCC(=O)c2cccs2 7a_103624766699_100011290775 [0,0,1,0,1,0|1,0,1]=4 1131 B20R2.11600 CCNc1ccccc1SCCC(=O)c2cccs2 62a_100011290775_114873767003 [0,0,1,0,1,0|1,0,1]=4 1132 B20R2.11600 CCNc1ccccc1SCCC(=O)c2cccs2 62a_114873767003_100011290775 [0,0,1,0,1,0|1,0,1]=4 1133 B20R2.11600 O=CNc1ccccc1SCCC(=O)c2cccs2 62a_100011290775_200020615051 [0,0,1,0,1,0|2,0,0]=4 1134 B20R2.11600 O=CNc1ccccc1SCCC(=O)c2cccs2 62a_200020615051_100011290775 [0,0,1,0,1,0|2,0,0]=4 1135 B20R2.174894 C/C(=C\c1ccccc1)/C=NNC(=O)c2cccs2 4a_100000184746_100016997181 [0,0,1,0,1,0|2,0,0]=4 1136 B20R2.174894 O=C(CCNC(=O)c1ccco1)Nc2ccccc2 11a_100000106764_100000184273 [0,0,1,0,1,0|1,1,0]=4 1137 B20R2.174894 O=C(CCNC(=O)c1ccco1)Nc2ccccc2 1626a_100000106764_100000184273 [0,0,1,0,1,0|1,1,0]=4 1138 B20R2.174894 O=C(CCNC(=O)c1ccco1)Nc2ccccc2 22a_100000106764_100000184273 [0,0,1,0,1,0|1,1,0]=4 1139 B20R2.174894 O=C(CCNC(=O)c1ccco1)Nc2ccccc2 527a_100000106764_100000184273 [0,0,1,0,1,0|1,1,0]=4 1140 B20R2.174894 O=C(CCNC(=O)c1cccs1)Cc2ccccc2 1458a_100000195306_100015291786 [0,0,1,0,1,0|2,0,0]=4 1141 B20R2.174894 O=C(CCNC(=O)c1cccs1)Nc2ccccc2 11a_100000106764_100000195306 [0,0,1,0,1,0|1,0,0]=3 1142 B20R2.174894 O=C(CCNC(=O)c1cccs1)Nc2ccccc2 1626a_100000106764_100000195306 [0,0,1,0,1,0|1,0,0]=3 1143 B20R2.174894 O=C(CCNC(=O)c1cccs1)Nc2ccccc2 22a_100000106764_100000195306 [0,0,1,0,1,0|1,0,0]=3 1144 B20R2.174894 O=C(CCNC(=O)c1cccs1)Nc2ccccc2 527a_100000106764_100000195306 [0,0,1,0,1,0|1,0,0]=3 1145 B20R2.174959 CC(=CC=NNC(=O)c1cccs1)c2ccccc2 4a_100000184746_200043867958 [0,0,1,0,1,0|1,0,1]=4 1146 B20R3.501 O=C(COc1csc2c1cccc2)c3cccs3 7a_100000077758_100000211436 [1,0,0,0,1,0|2,0,0]=4 1147 B20R3.501 O=C(CSc1c[nH]c2c1cccn2)c3cccs3 62a_100000211436_100011934613 [1,0,0,0,1,0|2,0,0]=4 1148 B20R3.501 O=C(CSc1c[nH]c2c1ccnc2)c3cccs3 62a_100000211436_100010232032 [1,0,0,0,1,0|2,0,0]=4 1149 B20R3.501 O=C(CSc1c[nH]c2c1cncc2)c3cccs3 62a_100000211436_100000753697 [1,0,0,0,1,0|2,0,0]=4 1150 B20R3.501 O=C(CSc1c[nH]c2c1nccc2)c3cccs3 62a_100000211436_100009817151 [1,0,0,0,1,0|2,0,0]=4 1151 B20R3.501 O=C(CSc1coc2c1cccc2)c3cccs3 62a_100000211436_100009812202 [1,0,0,0,1,0|2,0,0]=4 1152 B20R3.501 O=C(CSc1csc2c1cccc2)c3cccs3 62a_100000211436_100009813928 [1,0,0,0,1,0|2,0,0]=4 1153 B20R3.501 O=C(CSc1n[nH]c2c1cccc2)c3cccs3 62a_100000211436_100000050141 [1,0,0,0,1,0|2,0,0]=4 1154 B20R3.12920 Cc1[nH]c2ccccc2c1CCNc3ncns3 27a_100000750322_100000693119 [1,0,0,0,1,0|2,0,0]=4 1155 B20R3.12920 Cc1[nH]c2ccccc2c1CCNc3nncs3 27a_100000750322_100000739804 [1,0,0,0,1,0|2,0,0]=4 1156 B20R3.12920 Cc1sc2ccccc2c1CNCc3cccs3 207a_100000211653_100000066825 [1,0,0,0,1,0|1,0,1]=4 1157 B20R3.12920 Cc1sc2ccccc2c1CNCc3cccs3 270004a_100000211653_100000066825 [1,0,0,0,1,0|1,0,1]=4 1158 B22R2.360455 O=C(CCCNC(=O)c1cccs1)NCc2ccccc2 11a_100015324214_100000194764 [0,0,1,0,0,1|1,0,1]=4 1159 B22R2.360455 O=C(CCCNC(=O)c1cccs1)NCc2ccccc2 1626a_100015324214_100000194764 [0,0,1,0,0,1|1,0,1]=4 1160 B22R2.360455 O=C(CCCNC(=O)c1cccs1)NCc2ccccc2 240690a_100015324214_100000194764 [0,0,1,0,0,1|1,0,1]=4 1161 B22R2.360455 O=C(CCCNC(=O)c1cccs1)NCc2ccccc2 527a_100015324214_100000194764 [0,0,1,0,0,1|1,0,1]=4 1162 B22R2.360455 O=C(CCCNC(=O)c1cccs1)NNc2ccccc2 22a_100015195140_100000194764 [0,0,1,0,0,1|1,0,1]=4 1163 B22R2.2875220 O=C(Cc1cccs1)NCCCC(=O)Nc2ccccc2 11a_100000750157_100000210189 [0,0,1,0,0,1|1,0,1]=4 1164 B22R2.2875220 O=C(Cc1cccs1)NCCCC(=O)Nc2ccccc2 1626a_100000750157_100000210189 [0,0,1,0,0,1|1,0,1]=4 1165 B22R2.2875220 O=C(Cc1cccs1)NCCCC(=O)Nc2ccccc2 240690a_100000750157_100000210189 [0,0,1,0,0,1|1,0,1]=4 1166 B22R3.3220 O=C(NCCc1c[nH]c2c1cccc2)c3ccccc3 240690a_100000211132_100000185807 [1,0,0,0,0,1|1,0,0]=3 1167 B22R3.3220 O=C(NCCc1c[nH]c2c1cccc2)c3ccccc3 527a_100000211132_100000185807 [1,0,0,0,0,1|1,0,0]=3 1168 B22R3.3220 O=C(NCCc1coc2c1cccc2)c3ccccc3 11a_100011934666_100000185807 [1,0,0,0,0,1|2,0,0]=4 1169 B22R3.3220 O=C(NCCc1coc2c1cccc2)c3ccccc3 1626a_100011934666_100000185807 [1,0,0,0,0,1|2,0,0]=4 1170 B22R3.3220 O=C(NCCc1coc2c1cccc2)c3ccccc3 240690a_100011934666_100000185807 [1,0,0,0,0,1|2,0,0]=4 1171 B22R3.3220 O=C(NCCc1coc2c1cccc2)c3ccccc3 527a_100011934666_100000185807 [1,0,0,0,0,1|2,0,0]=4 1172 B22R3.3221 CC(Cc1cccs1)NCCc2c[nH]c3c2cccc3 2230a_100000751415_100011218569 [1,0,0,0,0,1|1,0,1]=4 1173 B22R3.3221 O=C(CCCc1c[nH]c2c1cccc2)Cc3cncs3 1458a_100000181718_100015185245 [1,0,0,0,0,1|2,0,0]=4 1174 B22R3.3221 O=C(CCCc1c[nH]c2c1cccc2)Cc3nccs3 1458a_100000181718_100015184050 [1,0,0,0,0,1|2,0,0]=4 1175 B22R3.3221 O=C(Cc1c[nH]cn1)NCCc2c[nH]c3c2cccc3 240690a_100000211132_100015291406 [1,0,0,0,0,1|2,0,0]=4 1176 B22R3.3221 O=C(Cc1ccc[nH]1)NCCc2c[nH]c3c2cccc3 240690a_100000211132_100000238377 [1,0,0,0,0,1|1,0,0]=3 1177 B22R3.3221 O=C(Cc1ccc[nH]1)NCCc2c[nH]c3c2cccc3 527a_100000211132_100000238377 [1,0,0,0,0,1|1,0,0]=3 1178 B22R3.3221 O=C(Cc1ccc[nH]1)NCCc2coc3c2cccc3 11a_100011934666_100000238377 [1,0,0,0,0,1|2,0,0]=4 1179 B22R3.3221 O=C(Cc1ccc[nH]1)NCCc2coc3c2cccc3 240690a_100011934666_100000238377 [1,0,0,0,0,1|2,0,0]=4 1180 B22R3.3221 O=C(Cc1ccc[nH]1)NCCc2coc3c2cccc3 527a_100011934666_100000238377 [1,0,0,0,0,1|2,0,0]=4 1181 B22R3.3221 O=C(Cc1ccco1)NCCc2c[nH]c3c2cccc3 527a_100000211132_100011217309 [1,0,0,0,0,1|0,1,0]=3 1182 B22R3.3221 O=C(Cc1ccco1)NCCc2coc3c2cccc3 11a_100011934666_100011217309 [1,0,0,0,0,1|1,1,0]=4 1183 B22R3.3221 O=C(Cc1ccco1)NCCc2coc3c2cccc3 527a_100011934666_100011217309 [1,0,0,0,0,1|1,1,0]=4 1184 B22R3.3221 O=C(Cc1cccs1)NCCc2c[nH]c3c2cccc3 240690a_100000211132_100000210189 [1,0,0,0,0,1|0,0,0]=2 1185 B22R3.3221 O=C(Cc1cccs1)NCCc2coc3c2cccc3 11a_100011934666_100000210189 [1,0,0,0,0,1|1,0,0]=3 1186 B22R3.3221 O=C(Cc1cccs1)NCCc2coc3c2cccc3 1626a_100011934666_100000210189 [1,0,0,0,0,1|1,0,0]=3 1187 B22R3.3221 O=C(Cc1cccs1)NCCc2coc3c2cccc3 240690a_100011934666_100000210189 [1,0,0,0,0,1|1,0,0]=3 1188 B22R3.3221 O=C(Cc1cccs1)NCCn2cnc3c2cccc3 11a_100000746447_100000210189 [1,0,0,0,0,1|1,0,1]=4 1189 B22R3.3221 O=C(Cc1cccs1)NCCn2cnc3c2cccc3 1626a_100000746447_100000210189 [1,0,0,0,0,1|1,0,1]=4 1190 B22R3.3221 O=C(Cc1cccs1)NCCn2cnc3c2cccc3 240690a_100000746447_100000210189 [1,0,0,0,0,1|1,0,1]=4 1191 B22R3.3221 O=C(Cc1cccs1)NN=Cc2c[nH]c3c2cccc3 4a_100000189772_100000182151 [1,0,0,0,0,1|1,0,1]=4 1192 B22R3.3221 O=C(Cc1ccn[nH]1)NCCc2c[nH]c3c2cccc3 240690a_100000211132_100000752941 [1,0,0,0,0,1|2,0,0]=4 1193 B22R3.3221 O=C(Cc1ccn[nH]1)NCCc2c[nH]c3c2cccc3 527a_100000211132_100000752941 [1,0,0,0,0,1|2,0,0]=4 1194 B22R3.3221 O=C(Cc1ccoc1)NCCc2c[nH]c3c2cccc3 240690a_100000211132_100000684892 [1,0,0,0,0,1|2,0,0]=4 1195 B22R3.3221 O=C(Cc1ccoc1)NCCc2c[nH]c3c2cccc3 527a_100000211132_100000684892 [1,0,0,0,0,1|2,0,0]=4 1196 B22R3.3221 O=C(Cc1ccsc1)NCCc2c[nH]c3c2cccc3 240690a_100000211132_100000184062 [1,0,0,0,0,1|2,0,0]=4 1197 B22R3.3221 O=C(Cc1ccsc1)NCCc2c[nH]c3c2cccc3 527a_100000211132_100000184062 [1,0,0,0,0,1|2,0,0]=4 1198 B22R3.3221 O=C(Cc1cscn1)NCCc2c[nH]c3c2cccc3 240690a_100000211132_100011438297 [1,0,0,0,0,1|2,0,0]=4 1199 B22R3.3221 O=C(Cc1cscn1)NCCc2c[nH]c3c2cccc3 527a_100000211132_100011438297 [1,0,0,0,0,1|2,0,0]=4 1200 B22R3.3221 O=C(Cn1cccc1)NCCc2c[nH]c3c2cccc3 527a_100000211132_100011196272 [1,0,0,0,0,1|2,0,0]=4 1201 B22R3.3221 O=C(Cn1cccn1)NCCc2c[nH]c3c2cccc3 240690a_100000211132_100000233772 [1,0,0,0,0,1|2,0,0]=4 1202 B22R3.3221 O=C(Cn1cccn1)NCCc2c[nH]c3c2cccc3 527a_100000211132_100000233772 [1,0,0,0,0,1|2,0,0]=4 1203 B22R3.36296 CC(NCCCc1c[nH]c2c1cccc2)c3cccs3 269862a_100102525078_100000185736 [1,0,0,0,0,1|1,0,1]=4 1204 B22R3.36296 O=C(CCSCc1csc2c1cccc2)c3cccs3 62a_100011290775_200000742921 [1,0,0,0,0,1|2,0,0]=4 1205 B22R3.36296 O=C(CCSCc1csc2c1cccc2)c3cccs3 62a_200000742921_100011290775 [1,0,0,0,0,1|2,0,0]=4 1206 B22R3.36296 O=C(CNCCc1c[nH]c2c1cccc2)c3cccs3 2230a_100000211132_100000211436 [1,0,0,0,0,1|0,0,0]=2 1207 B22R3.36296 O=C(CNCCc1c[nH]c2c1cccc2)c3ccsc3 2230a_100000211132_100011219462 [1,0,0,0,0,1|2,0,0]=4 1208 B22R3.36296 O=C(CNCCc1c[nH]c2c1cccc2)n3cccn3 2230a_100000211132_100000077511 [1,0,0,0,0,1|2,0,0]=4 1209 B22R3.36296 O=C(CNCCc1coc2c1cccc2)c3cccs3 2230a_100011934666_100000211436 [1,0,0,0,0,1|1,0,0]=3 1210 B22R3.36296 O=C(CSCCc1c[nH]c2c1cccc2)c3ccc[nH]3 62a_200011262396_100011218569 [1,0,0,0,0,1|2,0,0]=4 1211 B22R3.36296 O=C(CSCCc1c[nH]c2c1cccc2)c3ccco3 62a_100000211439_100011218569 [1,0,0,0,0,1|1,1,0]=4 1212 B22R3.36296 O=C(CSCCc1c[nH]c2c1cccc2)c3cccs3 62a_100000211436_100011218569 [1,0,0,0,0,1|1,0,0]=3 1213 B22R3.36296 O=C(CSCCc1c[nH]c2c1cccc2)c3nccs3 62a_100000718653_100011218569 [1,0,0,0,0,1|2,0,0]=4 1214 B22R3.36296 O=C(CSCCc1c[nH]c2c1cccn2)c3cccs3 62a_100000211436_100009895007 [1,0,0,0,0,1|2,0,0]=4 1215 B22R3.29178 Cc1[nH]c2ccccc2c1CCNCc3ccccc3 207a_100000750322_100015611070 [1,0,0,0,0,1|1,0,1]=4 1216 B22R3.29178 Cc1[nH]c2ccccc2c1CCNCc3ccccc3 270004a_100000750322_100015611070 [1,0,0,0,0,1|1,0,1]=4 1217 B22R3.29178 Cc1[nH]c2ccccc2c1CCNCc3ccccn3 207a_100000750322_100000209966 [1,0,0,0,0,1|1,0,1]=4 1218 B22R3.29178 Cc1[nH]c2ccccc2c1CCNCc3ccccn3 270004a_100000750322_100000209966 [1,0,0,0,0,1|1,0,1]=4 1219 B22R3.29178 Cc1[nH]c2ccccc2c1CCNCc3cccnc3 207a_100000750322_100000209961 [1,0,0,0,0,1|1,0,1]=4 1220 B22R3.29178 Cc1[nH]c2ccccc2c1CCNCc3cccnc3 270004a_100000750322_100000209961 [1,0,0,0,0,1|1,0,1]=4 1221 B22R3.29178 Cc1[nH]c2ccccc2c1CCNCc3ccncc3 207a_100000750322_100000186114 [1,0,0,0,0,1|1,0,1]=4 1222 B22R3.29178 Cc1[nH]c2ccccc2c1CCNCc3cnccn3 270004a_100000750322_100000749867 [1,0,0,0,0,1|1,0,1]=4 1223 B22R3.29178 Cc1[nH]c2ccccc2c1CCNCc3ncccn3 270004a_100000750322_100011532527 [1,0,0,0,0,1|1,0,1]=4 1224 B22R3.32815 Cc1ccc2ccccc2c1OCC(=O)c3cccs3 7a_100000039261_100000211436 [0,0,0,0,1,1|2,0,0]=4 1225 B22R3.32815 Cc1ccc2ccccc2c1SCC(=O)c3cccs3 62a_100000211436_100000759710 [0,0,0,0,1,1|2,0,0]=4 1226 B22R3.32815 Cc1ccc2ccccc2c1SCC(=O)c3cccs3 62a_100000759710_100000211436 [0,0,0,0,1,1|2,0,0]=4 1227 B22R3.32815 Cc1cnc2ccccc2c1SCC(=O)c3cccs3 62a_100000211436_100000092342 [0,0,0,0,1,1|1,0,1]=4 1228 B24R3.52829 O=C(CCSCc1nc2ccccc2[nH]c1=O)c3cccs3 62a_100000736137_100011290775 [0,0,0,0,0,2|2,0,0]=4 1229 B24R3.53013 Cc1cc(c2ccccc2n1)CSCCC(=O)c3cccs3 62a_100000755639_100011290775 [0,0,0,0,0,2|1,0,1]=4 1230 B24R3.53013 Cc1cc(c2ccccc2n1)CSCCC(=O)c3cccs3 62a_100011290775_100000755639 [0,0,0,0,0,2|1,0,1]=4 1231 B24R3.53132 Cc1[nH]c2ccccc2c1CCNC(=O)C[n+]3ccccc3 240690a_100000750322_200000086051 [0,0,0,0,0,2|2,0,0]=4 1232 B24R3.53132 Cc1[nH]c2ccccc2c1CCNC(=O)C[n+]3ccccc3 527a_100000750322_200000086051 [0,0,0,0,0,2|2,0,0]=4 1233 B24R3.53132 Cc1[nH]c2ccccc2c1CCNC(=O)Cc3cccnc3 240690a_100000750322_100000737805 [0,0,0,0,0,2|1,0,0]=3 1234 B24R3.53132 Cc1[nH]c2ccccc2c1CCNC(=O)Cc3cccnc3 527a_100000750322_100000737805 [0,0,0,0,0,2|1,0,0]=3 1235 B24R3.53132 Cc1[nH]c2ccccc2c1CCNC(=O)Cc3ccncc3 240690a_100000750322_100011201483 [0,0,0,0,0,2|1,0,0]=3 1236 B24R3.53132 Cc1[nH]c2ccccc2c1CCNC(=O)Cc3cnccn3 240690a_100000750322_100000726051 [0,0,0,0,0,2|1,0,0]=3 1237 B24R3.53132 Cc1[nH]c2ccccc2c1CCNC(=O)Cc3cnccn3 527a_100000750322_100000726051 [0,0,0,0,0,2|1,0,0]=3 1238 B24R3.53132 Cc1[nH]c2ccccc2c1CCNC(=O)Cc3cncnc3 240690a_100000750322_100000721575 [0,0,0,0,0,2|2,0,0]=4 1239 B24R3.53132 Cc1[nH]c2ccccc2c1CCNC(=O)Cc3cncnc3 527a_100000750322_100000721575 [0,0,0,0,0,2|2,0,0]=4 1240 B24R3.53132 Cc1[nH]c2ccccc2c1CCNC(=O)Nc3ccccc3 2430a_100000106764_100000750322 [0,0,0,0,0,2|1,0,0]=3 1241 B24R3.53138 Cc1[nH]c2ncccc2c1SCCNC(=O)c3ccccc3 62a_200011215302_100010174266 [0,0,0,0,0,2|2,0,0]=4 1242 B24R3.53138 Cc1oc2ccccc2c1SCCNC(=O)c3ccccc3 62a_200011215302_200010236113 [0,0,0,0,0,2|2,0,0]=4 1243 B24R3.53138 Cc1sc2ccccc2c1SCCNC(=O)c3ccccc3 62a_100010002616_200011215302 [0,0,0,0,0,2|2,0,0]=4 1244 B24R3.53138 Cc1sc2ccccc2c1SCCNC(=O)c3ccccc3 62a_200011215302_100010002616 [0,0,0,0,0,2|2,0,0]=4 1245 B24R3.58090 Cc1ccc2ccccc2c1CSCCC(=O)c3cccs3 62a_100000689653_100011290775 [0,0,0,0,0,2|2,0,0]=4 1246 B24R3.58090 Cc1ccc2ccccc2c1CSCCC(=O)c3cccs3 62a_100011290775_100000689653 [0,0,0,0,0,2|2,0,0]=4 1247 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)C=Cc3c[nH]cn3 240690a_100000750322_100102678534 [0,0,0,0,0,2|2,0,0]=4 1248 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)C=Cc3cccs3 240690a_100000750322_100000182767 [0,0,0,0,0,2|0,0,0]=2 1249 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)C=Cc3ccoc3 240690a_100000750322_100000238621 [0,0,0,0,0,2|2,0,0]=4 1250 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)C=Cc3ccsc3 240690a_100000750322_100000698588 [0,0,0,0,0,2|2,0,0]=4 1251 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)C=Cc3ccsc3 527a_100000750322_100000698588 [0,0,0,0,0,2|2,0,0]=4 1252 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)C=Cc3cscn3 240690a_100000750322_200000747928 [0,0,0,0,0,2|2,0,0]=4 1253 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)C=Cc3nccs3 240690a_100000750322_100102558208 [0,0,0,0,0,2|1,0,0]=3 1254 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)CCc3cc[nH]c3 240690a_100000750322_200000093579 [0,0,0,0,0,2|2,0,0]=4 1255 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)CCc3cc[nH]c3 527a_100000750322_200000093579 [0,0,0,0,0,2|2,0,0]=4 1256 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)CCc3ccc[nH]3 240690a_100000750322_200011998680 [0,0,0,0,0,2|1,0,0]=3 1257 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)CCc3ccc[nH]3 527a_100000750322_200011998680 [0,0,0,0,0,2|1,0,0]=3 1258 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)CCc3ccco3 527a_100000750322_100000185103 [0,0,0,0,0,2|0,1,0]=3 1259 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)CCc3cccs3 240690a_100000750322_100000185280 [0,0,0,0,0,2|0,0,0]=2 1260 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)CCc3cccs3 527a_100000750322_100000185280 [0,0,0,0,0,2|0,0,0]=2 1261 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)CCc3ccsc3 240690a_100000750322_100000195497 [0,0,0,0,0,2|2,0,0]=4 1262 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)CCc3ccsc3 527a_100000750322_100000195497 [0,0,0,0,0,2|2,0,0]=4 1263 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)CCc3cnc[nH]3 240690a_100000750322_100000044180 [0,0,0,0,0,2|2,0,0]=4 1264 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)CCc3cnc[nH]3 527a_100000750322_100000044180 [0,0,0,0,0,2|2,0,0]=4 1265 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)CCc3cncs3 240690a_100000750322_100012184922 [0,0,0,0,0,2|1,0,0]=3 1266 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)CCc3cncs3 527a_100000750322_100012184922 [0,0,0,0,0,2|1,0,0]=3 1267 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)CCc3ncc[nH]3 240690a_100000750322_100000722789 [0,0,0,0,0,2|2,0,0]=4 1268 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)CCc3ncc[nH]3 527a_100000750322_100000722789 [0,0,0,0,0,2|2,0,0]=4 1269 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)CCc3nccs3 240690a_100000750322_100000742873 [0,0,0,0,0,2|1,0,0]=3 1270 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)CCc3nccs3 527a_100000750322_100000742873 [0,0,0,0,0,2|1,0,0]=3 1271 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)CCn3cccc3 527a_100000750322_100011196273 [0,0,0,0,0,2|2,0,0]=4 1272 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)CCn3cccn3 240690a_100000750322_100000242649 [0,0,0,0,0,2|2,0,0]=4 1273 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)CCn3cccn3 527a_100000750322_100000242649 [0,0,0,0,0,2|2,0,0]=4 1274 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)CSc3nccs3 240690a_100000750322_100000739254 [0,0,0,0,0,2|1,0,0]=3 1275 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)NCc3c[nH]cn3 2708a_100000750322_100000758547 [0,0,0,0,0,2|2,0,0]=4 1276 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)NCc3c[nH]cn3 2708a_100000758547_100000750322 [0,0,0,0,0,2|2,0,0]=4 1277 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)NCc3c[nH]cn3 273464a_100000750322_100000758547 [0,0,0,0,0,2|2,0,0]=4 1278 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)NCc3c[nH]cn3 273464a_100000758547_100000750322 [0,0,0,0,0,2|2,0,0]=4 1279 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)NCc3c[nH]cn3 512a_100000750322_100000758547 [0,0,0,0,0,2|2,0,0]=4 1280 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)NCc3c[nH]cn3 512a_100000758547_100000750322 [0,0,0,0,0,2|2,0,0]=4 1281 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)NCc3cc[nH]n3 2708a_100000739516_100000750322 [0,0,0,0,0,2|2,0,0]=4 1282 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)NCc3cc[nH]n3 2708a_100000750322_100000739516 [0,0,0,0,0,2|2,0,0]=4 1283 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)NCc3cc[nH]n3 273464a_100000739516_100000750322 [0,0,0,0,0,2|2,0,0]=4 1284 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)NCc3cc[nH]n3 273464a_100000750322_100000739516 [0,0,0,0,0,2|2,0,0]=4 1285 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)NCc3cc[nH]n3 512a_100000739516_100000750322 [0,0,0,0,0,2|2,0,0]=4 1286 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)NCc3cc[nH]n3 512a_100000750322_100000739516 [0,0,0,0,0,2|2,0,0]=4 1287 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)NCc3ccc[nH]3 273464a_100000750322_100000764082 [0,0,0,0,0,2|1,0,0]=3 1288 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)NCc3ccc[nH]3 273464a_100000764082_100000750322 [0,0,0,0,0,2|1,0,0]=3 1289 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)NCc3ccc[nH]3 512a_100000750322_100000764082 [0,0,0,0,0,2|1,0,0]=3 1290 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)NCc3ccco3 2708a_100000185738_100000750322 [0,0,0,0,0,2|0,1,0]=3 1291 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)NCc3ccco3 2708a_100000750322_100000185738 [0,0,0,0,0,2|0,1,0]=3 1292 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)NCc3ccco3 273464a_100000185738_100000750322 [0,0,0,0,0,2|0,1,0]=3 1293 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)NCc3ccco3 512a_100000185738_100000750322 [0,0,0,0,0,2|0,1,0]=3 1294 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)NCc3ccco3 512a_100000750322_100000185738 [0,0,0,0,0,2|0,1,0]=3 1295 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)NCc3cccs3 2708a_100000211653_100000750322 [0,0,0,0,0,2|0,0,0]=2 1296 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)NCc3cccs3 2708a_100000750322_100000211653 [0,0,0,0,0,2|0,0,0]=2 1297 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)NCc3cccs3 273464a_100000211653_100000750322 [0,0,0,0,0,2|0,0,0]=2 1298 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)NCc3cccs3 273464a_100000750322_100000211653 [0,0,0,0,0,2|0,0,0]=2 1299 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)NCc3cccs3 512a_100000211653_100000750322 [0,0,0,0,0,2|0,0,0]=2 1300 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)NCc3cccs3 512a_100000750322_100000211653 [0,0,0,0,0,2|0,0,0]=2 1301 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)NCc3ccoc3 2708a_100000750322_100015206860 [0,0,0,0,0,2|2,0,0]=4 1302 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)NCc3ccoc3 2708a_100015206860_100000750322 [0,0,0,0,0,2|2,0,0]=4 1303 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)NCc3ccoc3 273464a_100000750322_100015206860 [0,0,0,0,0,2|2,0,0]=4 1304 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)NCc3ccoc3 273464a_100015206860_100000750322 [0,0,0,0,0,2|2,0,0]=4 1305 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)NCc3ccoc3 512a_100000750322_100015206860 [0,0,0,0,0,2|2,0,0]=4 1306 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)NCc3ccoc3 512a_100015206860_100000750322 [0,0,0,0,0,2|2,0,0]=4 1307 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)NCc3ccon3 2708a_100000688301_100000750322 [0,0,0,0,0,2|2,0,0]=4 1308 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)NCc3ccon3 2708a_100000750322_100000688301 [0,0,0,0,0,2|2,0,0]=4 1309 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)NCc3ccon3 273464a_100000688301_100000750322 [0,0,0,0,0,2|2,0,0]=4 1310 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)NCc3ccon3 273464a_100000750322_100000688301 [0,0,0,0,0,2|2,0,0]=4 1311 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)NCc3ccon3 512a_100000688301_100000750322 [0,0,0,0,0,2|2,0,0]=4 1312 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)NCc3ccon3 512a_100000750322_100000688301 [0,0,0,0,0,2|2,0,0]=4 1313 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)NCc3ccsc3 2708a_100000186416_100000750322 [0,0,0,0,0,2|2,0,0]=4 1314 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)NCc3ccsc3 2708a_100000750322_100000186416 [0,0,0,0,0,2|2,0,0]=4 1315 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)NCc3ccsc3 273464a_100000186416_100000750322 [0,0,0,0,0,2|2,0,0]=4 1316 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)NCc3ccsc3 273464a_100000750322_100000186416 [0,0,0,0,0,2|2,0,0]=4 1317 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)NCc3ccsc3 512a_100000186416_100000750322 [0,0,0,0,0,2|2,0,0]=4 1318 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)NCc3ccsc3 512a_100000750322_100000186416 [0,0,0,0,0,2|2,0,0]=4 1319 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)NCc3cnco3 2708a_100000750322_100020634212 [0,0,0,0,0,2|1,1,0]=4 1320 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)NCc3cnco3 2708a_100020634212_100000750322 [0,0,0,0,0,2|1,1,0]=4 1321 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)NCc3cnco3 273464a_100000750322_100020634212 [0,0,0,0,0,2|1,1,0]=4 1322 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)NCc3cnco3 273464a_100020634212_100000750322 [0,0,0,0,0,2|1,1,0]=4 1323 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)NCc3cnco3 512a_100000750322_100020634212 [0,0,0,0,0,2|1,1,0]=4 1324 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)NCc3cnco3 512a_100020634212_100000750322 [0,0,0,0,0,2|1,1,0]=4 1325 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)NCc3cncs3 2708a_100000750322_100016987365 [0,0,0,0,0,2|1,0,0]=3 1326 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)NCc3cncs3 2708a_100016987365_100000750322 [0,0,0,0,0,2|1,0,0]=3 1327 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)NCc3cncs3 273464a_100000750322_100016987365 [0,0,0,0,0,2|1,0,0]=3 1328 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)NCc3cncs3 273464a_100016987365_100000750322 [0,0,0,0,0,2|1,0,0]=3 1329 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)NCc3cncs3 512a_100000750322_100016987365 [0,0,0,0,0,2|1,0,0]=3 1330 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)NCc3cncs3 512a_100016987365_100000750322 [0,0,0,0,0,2|1,0,0]=3 1331 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)NCc3cocn3 2708a_100000750322_100015188801 [0,0,0,0,0,2|2,0,0]=4 1332 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)NCc3cocn3 2708a_100015188801_100000750322 [0,0,0,0,0,2|2,0,0]=4 1333 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)NCc3cocn3 273464a_100000750322_100015188801 [0,0,0,0,0,2|2,0,0]=4 1334 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)NCc3cocn3 273464a_100015188801_100000750322 [0,0,0,0,0,2|2,0,0]=4 1335 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)NCc3cocn3 512a_100000750322_100015188801 [0,0,0,0,0,2|2,0,0]=4 1336 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)NCc3cocn3 512a_100015188801_100000750322 [0,0,0,0,0,2|2,0,0]=4 1337 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)NCc3cscn3 2708a_100000750322_100015185402 [0,0,0,0,0,2|2,0,0]=4 1338 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)NCc3cscn3 2708a_100015185402_100000750322 [0,0,0,0,0,2|2,0,0]=4 1339 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)NCc3cscn3 273464a_100000750322_100015185402 [0,0,0,0,0,2|2,0,0]=4 1340 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)NCc3cscn3 273464a_100015185402_100000750322 [0,0,0,0,0,2|2,0,0]=4 1341 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)NCc3cscn3 512a_100000750322_100015185402 [0,0,0,0,0,2|2,0,0]=4 1342 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)NCc3cscn3 512a_100015185402_100000750322 [0,0,0,0,0,2|2,0,0]=4 1343 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)NCc3ncc[nH]3 2708a_100000750322_100000754540 [0,0,0,0,0,2|2,0,0]=4 1344 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)NCc3ncc[nH]3 2708a_100000754540_100000750322 [0,0,0,0,0,2|2,0,0]=4 1345 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)NCc3ncc[nH]3 273464a_100000750322_100000754540 [0,0,0,0,0,2|2,0,0]=4 1346 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)NCc3ncc[nH]3 273464a_100000754540_100000750322 [0,0,0,0,0,2|2,0,0]=4 1347 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)NCc3ncc[nH]3 512a_100000750322_100000754540 [0,0,0,0,0,2|2,0,0]=4 1348 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)NCc3ncc[nH]3 512a_100000754540_100000750322 [0,0,0,0,0,2|2,0,0]=4 1349 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)NCc3ncco3 2708a_100000750322_100016994969 [0,0,0,0,0,2|1,1,0]=4 1350 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)NCc3ncco3 2708a_100016994969_100000750322 [0,0,0,0,0,2|1,1,0]=4 1351 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)NCc3ncco3 273464a_100000750322_100016994969 [0,0,0,0,0,2|1,1,0]=4 1352 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)NCc3ncco3 273464a_100016994969_100000750322 [0,0,0,0,0,2|1,1,0]=4 1353 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)NCc3ncco3 512a_100000750322_100016994969 [0,0,0,0,0,2|1,1,0]=4 1354 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)NCc3ncco3 512a_100016994969_100000750322 [0,0,0,0,0,2|1,1,0]=4 1355 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)NCc3nccs3 2708a_100000740555_100000750322 [0,0,0,0,0,2|1,0,0]=3 1356 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)NCc3nccs3 2708a_100000750322_100000740555 [0,0,0,0,0,2|1,0,0]=3 1357 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)NCc3nccs3 273464a_100000740555_100000750322 [0,0,0,0,0,2|1,0,0]=3 1358 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)NCc3nccs3 273464a_100000750322_100000740555 [0,0,0,0,0,2|1,0,0]=3 1359 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)NCc3nccs3 512a_100000740555_100000750322 [0,0,0,0,0,2|1,0,0]=3 1360 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)NCc3nccs3 512a_100000750322_100000740555 [0,0,0,0,0,2|1,0,0]=3 1361 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)NNc3nccs3 273464a_100000750322_100011198208 [0,0,0,0,0,2|1,0,0]=3 1362 B24R3.52759 Cc1[nH]c2ccccc2c1CCNC(=O)NNc3nccs3 512a_100000750322_100011198208 [0,0,0,0,0,2|1,0,0]=3 1363 B24R3.52759 Cc1nc2ccccc2n1CCNC(=O)C=Cc3cccs3 11a_200000204690_100000182767 [0,0,0,0,0,2|1,0,1]=4 1364 B24R3.52759 Cc1nc2ccccc2n1CCNC(=O)C=Cc3cccs3 1626a_200000204690_100000182767 [0,0,0,0,0,2|1,0,1]=4 1365 B24R3.52759 Cc1nc2ccccc2n1CCNC(=O)C=Cc3cccs3 240690a_200000204690_100000182767 [0,0,0,0,0,2|1,0,1]=4 1366 B24R3.52759 Cc1nc2ccccc2n1CCNC(=O)CCc3cccs3 11a_200000204690_100000185280 [0,0,0,0,0,2|1,0,1]=4 1367 B24R3.52759 Cc1nc2ccccc2n1CCNC(=O)CCc3cccs3 1626a_200000204690_100000185280 [0,0,0,0,0,2|1,0,1]=4 1368 B24R3.52759 Cc1nc2ccccc2n1CCNC(=O)CCc3cccs3 240690a_200000204690_100000185280 [0,0,0,0,0,2|1,0,1]=4 1369 B24R3.52759 Cc1nc2ccccc2n1CCNC(=O)CCc3cccs3 527a_200000204690_100000185280 [0,0,0,0,0,2|1,0,1]=4 1370 B24R3.52759 Cc1nc2ccccc2n1CCNC(=O)NCc3cccs3 2708a_100000211653_200000204690 [0,0,0,0,0,2|1,0,1]=4 1371 B24R3.52759 Cc1nc2ccccc2n1CCNC(=O)NCc3cccs3 2708a_200000204690_100000211653 [0,0,0,0,0,2|1,0,1]=4 1372 B24R3.52759 Cc1nc2ccccc2n1CCNC(=O)NCc3cccs3 273464a_100000211653_200000204690 [0,0,0,0,0,2|1,0,1]=4 1373 B24R3.52759 Cc1nc2ccccc2n1CCNC(=O)NCc3cccs3 273464a_200000204690_100000211653 [0,0,0,0,0,2|1,0,1]=4 1374 B24R3.52759 Cc1nc2ccccc2n1CCNC(=O)NCc3cccs3 512a_200000204690_100000211653 [0,0,0,0,0,2|1,0,1]=4 1375 B24R3.52759 O=C(C=Cc1cccs1)NCCC2C(=O)Nc3c2cccc3 240690a_100000737811_100000182767 [0,0,0,0,0,2|1,0,1]=4 1376 B24R3.52759 O=C(C=Cc1cccs1)NCCn2c(=O)[nH]c3c2cccc3 11a_203549771432_100000182767 [0,0,0,0,0,2|2,0,0]=4 1377 B24R3.52759 O=C(C=Cc1cccs1)NCCn2c(=O)[nH]c3c2cccc3 240690a_203549771432_100000182767 [0,0,0,0,0,2|2,0,0]=4 1378 B24R3.52759 O=C(CCc1cccs1)NCCC2C(=O)Nc3c2cccc3 240690a_100000737811_100000185280 [0,0,0,0,0,2|1,0,1]=4 1379 B24R3.52759 O=C(CCc1cccs1)NCCn2c(=O)[nH]c3c2cccc3 11a_203549771432_100000185280 [0,0,0,0,0,2|2,0,0]=4 1380 B24R3.52759 O=C(CCc1cccs1)NCCn2c(=O)[nH]c3c2cccc3 240690a_203549771432_100000185280 [0,0,0,0,0,2|2,0,0]=4 1381 B24R3.52759 O=C(CCc1cccs1)NCCn2c(=O)[nH]c3c2cccc3 527a_203549771432_100000185280 [0,0,0,0,0,2|2,0,0]=4 1382 B24R3.52759 O=C(NCCC1C(=O)Nc2c1cccc2)NCc3cccs3 273464a_100000211653_100000737811 [0,0,0,0,0,2|1,0,1]=4 1383 B24R3.52759 O=C(NCCC1C(=O)Nc2c1cccc2)NCc3cccs3 273464a_100000737811_100000211653 [0,0,0,0,0,2|1,0,1]=4 1384 B24R3.52759 O=C(NCCC1C(=O)Nc2c1cccc2)NCc3cccs3 512a_100000211653_100000737811 [0,0,0,0,0,2|1,0,1]=4 1385 B24R3.52759 O=C(NCCC1C(=O)Nc2c1cccc2)NCc3cccs3 512a_100000737811_100000211653 [0,0,0,0,0,2|1,0,1]=4 1386 B24R3.52759 O=C(NCCn1c(=O)[nH]c2c1cccc2)NCc3cccs3 2708a_100000211653_203549771432 [0,0,0,0,0,2|2,0,0]=4 1387 B24R3.52759 O=C(NCCn1c(=O)[nH]c2c1cccc2)NCc3cccs3 2708a_203549771432_100000211653 [0,0,0,0,0,2|2,0,0]=4 1388 B24R3.52759 O=C(NCCn1c(=O)[nH]c2c1cccc2)NCc3cccs3 273464a_100000211653_203549771432 [0,0,0,0,0,2|2,0,0]=4 1389 B24R3.52759 O=C(NCCn1c(=O)[nH]c2c1cccc2)NCc3cccs3 273464a_203549771432_100000211653 [0,0,0,0,0,2|2,0,0]=4 1390 B24R3.52759 O=C(NCCn1c(=O)[nH]c2c1cccc2)NCc3cccs3 512a_100000211653_203549771432 [0,0,0,0,0,2|2,0,0]=4