0 B30R4.2047054 CC(C)Oc1ccc(cc1C#N)c2nc(no2)c3ccc4c(c3)CCCN4 270196a_100012279141_100010204700 [0,0,0,0,0,0|2,0,0]=2 1 B30R4.2047054 CC(C)Oc1ccc(cc1C#N)c2nc(no2)c3ccc4c(c3)CCNC4 270196a_100016988750_100010204700 [0,0,0,0,0,0|0,0,0]=0 2 B30R4.2047054 CC(C)Oc1ccc(cc1C#N)c2nc(no2)c3ccc4c(c3)CNCC4 270196a_100000067367_100010204700 [0,0,0,0,0,0|2,0,0]=2 3 B30R4.2047054 CC(C)Oc1ccc(cc1C#N)c2nc(no2)c3ccc4c(c3)OCCN4 270196a_100009880310_100010204700 [0,0,0,0,0,0|3,0,0]=3 4 B30R4.2047054 CC(C)Oc1ccc(cc1C#N)c2nc(no2)c3ccc4c(c3)OCCO4 270196a_100000753975_100010204700 [0,0,0,0,0,0|3,0,0]=3 5 B30R4.2047054 CC(C)Oc1ccc(cc1C#N)c2nc(no2)c3ccc4ccncc4c3 270196a_200000070123_100010204700 [0,0,0,0,0,0|2,0,2]=4 6 B30R4.2047054 CC(C)Oc1ccc(cc1C#N)c2nc(no2)c3ccc4cnccc4c3 270196a_100000070567_100010204700 [0,0,0,0,0,0|0,0,4]=4 7 B30R4.2047054 CC(C)Oc1ccc(cc1C#N)c2nc(no2)c3ccc4ncccc4c3 270196a_100011301663_100010204700 [0,0,0,0,0,0|2,0,2]=4 8 B30R4.2047054 CC(C)Oc1ccc(cc1C#N)c2nc(no2)c3ccc4nccnc4c3 270196a_100000756153_100010204700 [0,0,0,0,0,0|3,0,1]=4 9 B30R4.2047054 COc1cc(ccc1OC(=O)C)c2nc(no2)c3ccc4c(c3)CCNC4 270196a_100016988750_100000056858 [0,0,0,0,0,0|3,0,1]=4 10 B30R4.2047054 COc1cc(ccc1OC(C)C)c2nc(no2)c3ccc4c(c3)CCCN4 270196a_100012279141_100000182801 [0,0,0,0,0,0|4,0,0]=4 11 B30R4.2047054 COc1cc(ccc1OC(C)C)c2nc(no2)c3ccc4c(c3)CCNC4 270196a_100016988750_100000182801 [0,0,0,0,0,0|2,0,0]=2 12 B30R4.2047054 COc1cc(ccc1OC(C)C)c2nc(no2)c3ccc4c(c3)CNCC4 270196a_100000067367_100000182801 [0,0,0,0,0,0|4,0,0]=4 13 B30R4.2047054 COc1cc(ccc1OC(F)F)c2nc(no2)c3ccc4c(c3)CCNC4 270196a_100016988750_100000183218 [0,0,0,0,0,0|4,0,0]=4 14 B29R4.2885613 CC(C)Oc1ccc(cc1Br)c2nc(no2)c3ccc4c(c3)CCNC4 270196a_100016988750_100000243735 [1,0,0,0,0,0|1,0,0]=2 15 B29R4.2885613 CC(C)Oc1ccc(cc1Br)c2nc(no2)c3ccc4c(c3)CNCC4 270196a_100000067367_100000243735 [1,0,0,0,0,0|3,0,0]=4 16 B29R4.2885613 CC(C)Oc1ccc(cc1Cl)c2nc(no2)c3ccc4c(c3)CCNC4 270196a_100016988750_100011453123 [1,0,0,0,0,0|1,0,0]=2 17 B29R4.2885613 CC(C)Oc1ccc(cc1Cl)c2nc(no2)c3ccc4c(c3)CNCC4 270196a_100000067367_100011453123 [1,0,0,0,0,0|3,0,0]=4 18 B29R4.2885613 CC(C)Oc1ccc(cc1F)c2nc(no2)c3ccc4c(c3)CCCN4 270196a_100012279141_200011234205 [1,0,0,0,0,0|3,0,0]=4 19 B29R4.2885613 CC(C)Oc1ccc(cc1F)c2nc(no2)c3ccc4c(c3)CCNC4 270196a_100016988750_200011234205 [1,0,0,0,0,0|1,0,0]=2 20 B29R4.2885613 CC(C)Oc1ccc(cc1F)c2nc(no2)c3ccc4c(c3)CNCC4 270196a_100000067367_200011234205 [1,0,0,0,0,0|3,0,0]=4 21 B29R4.2885613 CC(C)Oc1ccc(cc1I)c2nc(no2)c3ccc4c(c3)CCNC4 270196a_100016988750_100012355715 [1,0,0,0,0,0|1,0,0]=2 22 B29R4.2885613 CC(C)Oc1ccc(cc1I)c2nc(no2)c3ccc4c(c3)CNCC4 270196a_100000067367_100012355715 [1,0,0,0,0,0|3,0,0]=4 23 B29R4.2885613 Cc1cc(ccc1OC(C)C)c2nc(no2)c3ccc4c(c3)CCCN4 270196a_100012279141_200011734124 [1,0,0,0,0,0|2,0,1]=4 24 B29R4.2885613 Cc1cc(ccc1OC(C)C)c2nc(no2)c3ccc4c(c3)CCNC4 270196a_100016988750_200011734124 [1,0,0,0,0,0|0,0,1]=2 25 B29R4.2885613 Cc1cc(ccc1OC(C)C)c2nc(no2)c3ccc4c(c3)CNCC4 270196a_100000067367_200011734124 [1,0,0,0,0,0|2,0,1]=4 26 B29R4.2885613 Oc1cc(ccc1OC(F)F)c2nc(no2)c3ccc4c(c3)CCNC4 270196a_100016988750_100010441376 [1,0,0,0,0,0|3,0,0]=4 27 B29R4.3068902 CCOc1ccc(cc1C#N)c2nc(no2)c3ccc4c(c3)CCCN4 270196a_100012279141_100000092412 [1,0,0,0,0,0|2,0,0]=3 28 B29R4.3068902 CCOc1ccc(cc1C#N)c2nc(no2)c3ccc4c(c3)CCNC4 270196a_100016988750_100000092412 [1,0,0,0,0,0|0,0,0]=1 29 B29R4.3068902 CCOc1ccc(cc1C#N)c2nc(no2)c3ccc4c(c3)CNCC4 270196a_100000067367_100000092412 [1,0,0,0,0,0|2,0,0]=3 30 B29R4.3068902 CCOc1ccc(cc1C#N)c2nc(no2)c3ccc4c(c3)OCCN4 270196a_100009880310_100000092412 [1,0,0,0,0,0|3,0,0]=4 31 B29R4.3068902 CCOc1ccc(cc1C#N)c2nc(no2)c3ccc4c(c3)OCCO4 270196a_100000753975_100000092412 [1,0,0,0,0,0|3,0,0]=4 32 B29R4.3068902 CCOc1ccc(cc1OC)c2nc(no2)c3ccc4c(c3)CCNC4 270196a_100016988750_100000184834 [1,0,0,0,0,0|2,0,0]=3 33 B31R4.18519640 CC(C)Oc1ccc(cc1C#N)c2nc(no2)c3ccc4c(c3)C(=O)CCO4 270196a_200000045970_100010204700 [0,1,0,0,0,0|2,0,1]=4 34 B31R4.103276344 CC(C)Oc1ccc(cc1[N+](=O)[O-])c2nc(no2)c3ccc4c(c3)CCNC4 270196a_100016988750_100000244681 [0,1,0,0,0,0|2,0,0]=3 35 B31R4.151327742 CC(C)Oc1ccc(cc1C#N)c2nc(no2)c3cc4c([nH]c3=O)CCCC4 270196a_100011292548_100010204700 [0,1,0,0,0,0|2,0,0]=3 36 B31R4.151327742 CC(C)Oc1ccc(cc1C#N)c2nc(no2)c3cc4c(nc3Cl)CCCC4 270196a_100000186327_100010204700 [0,1,0,0,0,0|2,0,0]=3 37 B31R4.151328463 CC(C)Oc1ccc(cc1C#N)c2nc(no2)c3ccc4c(c3)CCCC4=O 270196a_100000079117_100010204700 [0,1,0,0,0,0|1,0,1]=3 38 B29R3.3290286 CC(C)Oc1ccc(cc1C#N)c2nc(no2)c3ccc(cc3)CCCO 270196a_100000090602_100010204700 [0,0,1,0,0,0|2,0,0]=3 39 B29R3.3290286 CC(C)Oc1ccc(cc1C#N)c2nc(no2)c3ccc(cc3)OCCO 270196a_100000230533_100010204700 [0,0,1,0,0,0|3,0,0]=4 40 B29R3.3290286 CCCNc1ccc(cc1)c2noc(n2)c3ccc(c(c3)C#N)OC(C)C 270196a_200000237418_100010204700 [0,0,1,0,0,0|2,0,0]=3 41 B29R3.3290286 CCCOc1ccc(cc1)c2noc(n2)c3ccc(c(c3)C#N)OC(C)C 270196a_100000170014_100010204700 [0,0,1,0,0,0|2,0,0]=3 42 B29R3.3290286 CCOCc1ccc(cc1)c2noc(n2)c3ccc(c(c3)C#N)OC(C)C 270196a_100000737326_100010204700 [0,0,1,0,0,0|1,0,0]=2 43 B29R3.3290286 CCOCc1ccc(cc1)c2noc(n2)c3ccc(c(c3)OC)OC(C)C 270196a_100000737326_100000182801 [0,0,1,0,0,0|3,0,0]=4 44 B29R3.10826020 C#CCOc1cccc(c1)c2noc(n2)c3ccc(c(c3)C#N)OC(C)C 270196a_100000172748_100010204700 [0,0,1,0,0,0|2,0,1]=4 45 B29R3.10826020 CCCOc1cccc(c1)c2noc(n2)c3ccc(c(c3)C#N)OC(C)C 270196a_100000172522_100010204700 [0,0,1,0,0,0|2,0,0]=3 46 B29R3.16297265 COc1cc(ccc1C=O)c2noc(n2)c3ccc(c(c3)C#N)OC(C)C 270196a_100000050422_100010204700 [0,0,1,0,0,0|2,0,1]=4 47 B29R3.16297265 COc1cc(ccc1CO)c2noc(n2)c3ccc(c(c3)C#N)OC(C)C 270196a_100000102359_100010204700 [0,0,1,0,0,0|2,0,0]=3 48 B29R3.16297265 COc1ccc(cc1OC)c2noc(n2)c3ccc(c(c3)C#N)OC(C)C 270196a_100000173364_100010204700 [0,0,1,0,0,0|3,0,0]=4 49 B29R3.94994673 CCOc1cc(ccc1O)c2noc(n2)c3ccc(c(c3)C#N)OC(C)C 270196a_100000181481_100010204700 [0,0,1,0,0,0|3,0,0]=4 50 B31R5.178751845 CC(C)n1nnc2c1ccc(c2)c3nc(no3)c4ccc5c(c4)CCNC5 270196a_100016988750_100011217980 [0,0,0,1,0,0|2,0,1]=4 51 B29R4.2038500 CC(C)Oc1ccc(cc1C#N)c2nc(no2)c3ccc4[nH]ccc4c3 270196a_100000766051_100010204700 [0,0,0,0,1,0|0,0,2]=3 52 B29R4.2038500 CC(C)Oc1ccc(cc1C#N)c2nc(no2)c3ccc4[nH]ccc4n3 270196a_100000095969_100010204700 [0,0,0,0,1,0|1,0,2]=4 53 B29R4.2038500 CC(C)Oc1ccc(cc1C#N)c2nc(no2)c3ccc4[nH]cnc4c3 270196a_100000759558_100010204700 [0,0,0,0,1,0|1,0,1]=3 54 B29R4.2038500 CC(C)Oc1ccc(cc1C#N)c2nc(no2)c3ccc4[nH]ncc4c3 270196a_100102524907_100010204700 [0,0,0,0,1,0|1,0,1]=3 55 B29R4.2038500 CC(C)Oc1ccc(cc1C#N)c2nc(no2)c3ccc4[nH]ncc4n3 270196a_100009845281_100010204700 [0,0,0,0,1,0|2,0,1]=4 56 B29R4.2038500 CC(C)Oc1ccc(cc1C#N)c2nc(no2)c3ccc4[nH]nnc4c3 270196a_100000072070_100010204700 [0,0,0,0,1,0|2,0,0]=3 57 B29R4.2038500 CC(C)Oc1ccc(cc1C#N)c2nc(no2)c3ccc4c(c3)CCN4 270196a_100011198519_100010204700 [0,0,0,0,1,0|0,0,0]=1 58 B29R4.2038500 CC(C)Oc1ccc(cc1C#N)c2nc(no2)c3ccc4c(c3)CCO4 270196a_100011216889_100010204700 [0,0,0,0,1,0|1,0,0]=2 59 B29R4.2038500 CC(C)Oc1ccc(cc1C#N)c2nc(no2)c3ccc4c(c3)OCO4 270196a_100000188249_100010204700 [0,0,0,0,1,0|2,0,0]=3 60 B29R4.2038500 CC(C)Oc1ccc(cc1C#N)c2nc(no2)c3ccc4cc[nH]c4c3 270196a_100000684890_100010204700 [0,0,0,0,1,0|1,0,2]=4 61 B29R4.2038500 CC(C)Oc1ccc(cc1C#N)c2nc(no2)c3ccc4cn[nH]c4c3 270196a_100000067906_100010204700 [0,0,0,0,1,0|1,0,2]=4 62 B29R4.2038500 CC(C)Oc1ccc(cc1C#N)c2nc(no2)c3ccc4ncsc4c3 270196a_100011935325_100010204700 [0,0,0,0,1,0|1,0,2]=4 63 B29R4.2038500 CC(C)Oc1ccc(cc1C#N)c2nc(no2)c3ccc4nonc4c3 270196a_100000034446_100010204700 [0,0,0,0,1,0|2,0,1]=4 64 B29R4.2038500 CC(C)Oc1ccc(cc1C#N)c2nc(no2)c3ccc4occc4c3 270196a_100000067691_100010204700 [0,0,0,0,1,0|1,0,2]=4 65 B29R4.2038500 CC(C)Oc1ccc(cc1C#N)c2nc(no2)c3ccc4ocnc4c3 270196a_100000059401_100010204700 [0,0,0,0,1,0|2,0,1]=4 66 B29R4.2038500 CC(C)Oc1ccc(cc1C#N)c2nc(no2)c3ccc4scnc4c3 270196a_100000084195_100010204700 [0,0,0,0,1,0|2,0,1]=4 67 B29R4.2038500 CC(C)Oc1ccc(cc1C#N)c2nc(no2)c3cnc4[nH]ccc4c3 270196a_100000061668_100010204700 [0,0,0,0,1,0|1,0,2]=4 68 B29R4.2038500 CC(C)Oc1ccc(cc1C#N)c2nc(no2)c3cnc4[nH]ncc4c3 270196a_100009886748_100010204700 [0,0,0,0,1,0|2,0,1]=4 69 B29R4.2038500 COc1cc(ccc1OC(C)C)c2nc(no2)c3ccc4c(c3)CCN4 270196a_100011198519_100000182801 [0,0,0,0,1,0|2,0,0]=3 70 B29R4.2038500 COc1cc(ccc1OC(C)C)c2nc(no2)c3ccc4c(c3)CCO4 270196a_100011216889_100000182801 [0,0,0,0,1,0|3,0,0]=4 71 B31R4.18761521 COc1cc(ccc1OC(C)C)Cc2nc(no2)c3ccc4c(c3)CCNC4 270196a_100016988750_100010294056 [0,0,0,0,0,1|2,0,0]=3 72 B31R4.104400218 COc1cc(ccc1OCC(C)C)c2nc(no2)c3ccc4c(c3)CCNC4 270196a_100016988750_100000182899 [0,0,0,0,0,1|2,0,0]=3 73 B28R3.20240 CCOCc1ccc(cc1)c2noc(n2)c3ccc(c(c3)F)OC(C)C 270196a_100000737326_200011234205 [1,0,1,0,0,0|2,0,0]=4 74 B28R3.2175156 CC(C)Oc1ccc(cc1C#N)c2nc(no2)c3ccc(cc3)CCO 270196a_100011219507_100010204700 [1,0,1,0,0,0|1,0,0]=3 75 B28R3.2175156 CCCc1ncc(cn1)c2noc(n2)c3ccc(c(c3)C#N)OC(C)C 270196a_100000099252_100010204700 [1,0,1,0,0,0|2,0,0]=4 76 B28R3.2175156 CCNc1ccc(cc1)c2noc(n2)c3ccc(c(c3)C#N)OC(C)C 270196a_100000218877_100010204700 [1,0,1,0,0,0|0,0,0]=2 77 B28R3.2175156 CCNc1ccc(cc1)c2noc(n2)c3ccc(c(c3)OC)OC(C)C 270196a_100000218877_100000182801 [1,0,1,0,0,0|2,0,0]=4 78 B28R3.2175156 CCNc1ccc(cn1)c2noc(n2)c3ccc(c(c3)C#N)OC(C)C 270196a_100000242243_100010204700 [1,0,1,0,0,0|1,0,0]=3 79 B28R3.2175156 CCNc1ncc(cn1)c2noc(n2)c3ccc(c(c3)C#N)OC(C)C 270196a_100000099255_100010204700 [1,0,1,0,0,0|2,0,0]=4 80 B28R3.2175156 CCOc1ccc(cc1)c2noc(n2)c3ccc(c(c3)C#N)OC(C)C 270196a_100000170012_100010204700 [1,0,1,0,0,0|1,0,0]=3 81 B28R3.2175156 CCOc1ccc(cn1)c2noc(n2)c3ccc(c(c3)C#N)OC(C)C 270196a_100000740938_100010204700 [1,0,1,0,0,0|2,0,0]=4 82 B28R3.2175156 CNCc1ccc(cc1)c2noc(n2)c3ccc(c(c3)C#N)OC(C)C 270196a_100000217971_100010204700 [1,0,1,0,0,0|0,0,0]=2 83 B28R3.2175156 CNCc1ccc(cc1)c2noc(n2)c3ccc(c(c3)OC)OC(C)C 270196a_100000217971_100000182801 [1,0,1,0,0,0|2,0,0]=4 84 B28R3.2175156 COCc1ccc(cc1)c2noc(n2)c3ccc(c(c3)C#N)OC(C)C 270196a_100000741963_100010204700 [1,0,1,0,0,0|1,0,0]=3 85 B28R3.2175156 CSCc1ccc(cc1)c2noc(n2)c3ccc(c(c3)C#N)OC(C)C 270196a_200000741070_100010204700 [1,0,1,0,0,0|1,0,0]=3 86 B28R3.3067733 CCCNc1ccc(cc1)c2noc(n2)c3ccc(c(c3)C#N)OCC 270196a_200000237418_100000092412 [1,0,1,0,0,0|2,0,0]=4 87 B28R3.3067733 CCCOc1ccc(cc1)c2noc(n2)c3ccc(c(c3)C#N)OCC 270196a_100000170014_100000092412 [1,0,1,0,0,0|2,0,0]=4 88 B28R3.3067733 CCOCc1ccc(cc1)c2noc(n2)c3ccc(c(c3)C#N)OCC 270196a_100000737326_100000092412 [1,0,1,0,0,0|1,0,0]=3 89 B28R3.3067733 CCOc1ccc(cc1C#N)c2nc(no2)c3ccc(cc3)CCCO 270196a_100000090602_100000092412 [1,0,1,0,0,0|2,0,0]=4 90 B28R3.6275585 CC(C)Oc1ccc(cc1C#N)c2nc(no2)c3cccc(c3)CCO 270196a_100012001419_100010204700 [1,0,1,0,0,0|1,0,0]=3 91 B28R3.6275585 CCCc1cc(ccn1)c2noc(n2)c3ccc(c(c3)C#N)OC(C)C 270196a_100000094184_100010204700 [1,0,1,0,0,0|1,0,0]=3 92 B28R3.6275585 CCNc1cccc(c1)c2noc(n2)c3ccc(c(c3)C#N)OC(C)C 270196a_100000221300_100010204700 [1,0,1,0,0,0|1,0,0]=3 93 B28R3.6275585 CCOc1cccc(c1)c2noc(n2)c3ccc(c(c3)C#N)OC(C)C 270196a_100000172519_100010204700 [1,0,1,0,0,0|1,0,0]=3 94 B28R3.6275585 CNCc1cccc(c1)c2noc(n2)c3ccc(c(c3)C#N)OC(C)C 270196a_100000168042_100010204700 [1,0,1,0,0,0|0,0,0]=2 95 B28R3.6275585 CNCc1cccc(c1)c2noc(n2)c3ccc(c(c3)OC)OC(C)C 270196a_100000168042_100000182801 [1,0,1,0,0,0|2,0,0]=4 96 B28R3.6275585 CSCc1cccc(c1)c2noc(n2)c3ccc(c(c3)C#N)OC(C)C 270196a_100000750944_100010204700 [1,0,1,0,0,0|1,0,0]=3 97 B28R3.8444983 CCCOc1cccc(c1)c2noc(n2)c3ccc(c(c3)C#N)OCC 270196a_100000172522_100000092412 [1,0,1,0,0,0|2,0,0]=4 98 B28R3.12063488 CC(C)Oc1ccc(cc1C#N)c2nc(no2)c3ccc(c(c3)Br)CO 270196a_100010214422_100010204700 [1,0,1,0,0,0|2,0,0]=4 99 B28R3.12063488 CC(C)Oc1ccc(cc1C#N)c2nc(no2)c3ccc(c(c3)F)CO 270196a_100000752871_100010204700 [1,0,1,0,0,0|2,0,0]=4 100 B28R3.12063488 CNc1ccc(cc1I)c2noc(n2)c3ccc(c(c3)C#N)OC(C)C 270196a_200020994358_100010204700 [1,0,1,0,0,0|1,0,0]=3 101 B28R3.12063488 COc1ccc(cc1Br)c2noc(n2)c3ccc(c(c3)C#N)OC(C)C 270196a_100000188253_100010204700 [1,0,1,0,0,0|2,0,0]=4 102 B28R3.12063488 COc1ccc(cc1C)c2noc(n2)c3ccc(c(c3)C#N)OC(C)C 270196a_100000189344_100010204700 [1,0,1,0,0,0|1,0,0]=3 103 B28R3.12063488 COc1ccc(cc1Cl)c2noc(n2)c3ccc(c(c3)C#N)OC(C)C 270196a_100000189300_100010204700 [1,0,1,0,0,0|2,0,0]=4 104 B28R3.12063488 COc1ccc(cc1F)c2noc(n2)c3ccc(c(c3)C#N)OC(C)C 270196a_100011216750_100010204700 [1,0,1,0,0,0|2,0,0]=4 105 B28R3.12063488 COc1ccc(cc1I)c2noc(n2)c3ccc(c(c3)C#N)OC(C)C 270196a_100010089744_100010204700 [1,0,1,0,0,0|2,0,0]=4 106 B28R3.12063488 COc1ccc(cc1O)c2noc(n2)c3ccc(c(c3)C#N)OC(C)C 270196a_100000188611_100010204700 [1,0,1,0,0,0|2,0,0]=4 107 B28R3.12063488 Cc1cc(ccc1C=O)c2noc(n2)c3ccc(c(c3)C#N)OC(C)C 270196a_100012187669_100010204700 [1,0,1,0,0,0|1,0,1]=4 108 B28R3.13887375 CC(C)Oc1ccc(cc1C#N)c2nc(no2)c3ccc(c(c3)CO)Br 270196a_100010246249_100010204700 [1,0,1,0,0,0|2,0,0]=4 109 B28R3.13887375 CC(C)Oc1ccc(cc1C#N)c2nc(no2)c3ccc(c(c3)CO)F 270196a_100000757149_100010204700 [1,0,1,0,0,0|2,0,0]=4 110 B28R3.13887375 CCc1cc(ccc1F)c2noc(n2)c3ccc(c(c3)C#N)OC(C)C 270196a_100009839933_100010204700 [1,0,1,0,0,0|1,0,0]=3 111 B28R3.13887375 COc1cc(ccc1Br)c2noc(n2)c3ccc(c(c3)C#N)OC(C)C 270196a_100012356288_100010204700 [1,0,1,0,0,0|2,0,0]=4 112 B28R3.13887375 COc1cc(ccc1C)c2noc(n2)c3ccc(c(c3)C#N)OC(C)C 270196a_100000691863_100010204700 [1,0,1,0,0,0|1,0,0]=3 113 B28R3.13887375 COc1cc(ccc1Cl)c2noc(n2)c3ccc(c(c3)C#N)OC(C)C 270196a_100012184456_100010204700 [1,0,1,0,0,0|2,0,0]=4 114 B28R3.13887375 COc1cc(ccc1F)c2noc(n2)c3ccc(c(c3)C#N)OC(C)C 270196a_100000757636_100010204700 [1,0,1,0,0,0|2,0,0]=4 115 B28R3.13887375 COc1cc(ccc1O)c2noc(n2)c3ccc(c(c3)C#N)OC(C)C 270196a_100000184589_100010204700 [1,0,1,0,0,0|2,0,0]=4 116 B28R3.13887375 Cc1ccc(cc1CO)c2noc(n2)c3ccc(c(c3)C#N)OC(C)C 270196a_200009860882_100010204700 [1,0,1,0,0,0|1,0,0]=3 117 B28R3.27039250 CCOc1ccc(cc1C#N)c2nc(no2)c3ccc(c(c3)OC)CO 270196a_100000102359_100000092412 [1,0,1,0,0,0|2,0,0]=4 118 B28R4.295373 CC(=O)Oc1ccc(cc1)c2nc(no2)c3ccc4c(c3)CCNC4 270196a_100016988750_100000188978 [2,0,0,0,0,0|1,0,1]=4 119 B28R4.295373 CC(C)Cc1ccc(cc1)c2nc(no2)c3ccc4c(c3)CCNC4 270196a_100016988750_100000185289 [2,0,0,0,0,0|1,0,0]=3 120 B28R4.295373 CC(C)Oc1ccc(cc1)c2nc(no2)c3ccc4c(c3)CCCN4 270196a_100012279141_100000182917 [2,0,0,0,0,0|2,0,0]=4 121 B28R4.295373 CC(C)Oc1ccc(cc1)c2nc(no2)c3ccc4c(c3)CCNC4 270196a_100016988750_100000182917 [2,0,0,0,0,0|0,0,0]=2 122 B28R4.295373 CC(C)Oc1ccc(cc1)c2nc(no2)c3ccc4c(c3)CNCC4 270196a_100000067367_100000182917 [2,0,0,0,0,0|2,0,0]=4 123 B28R4.295373 CC(C)Sc1ccc(cc1)c2nc(no2)c3ccc4c(c3)CCNC4 270196a_100016988750_100000244970 [2,0,0,0,0,0|0,1,0]=3 124 B28R4.295373 CN(C)Cc1ccc(cc1)c2nc(no2)c3ccc4c(c3)CCNC4 270196a_100016988750_100000749272 [2,0,0,0,0,0|2,0,0]=4 125 B28R4.295373 FC(F)Oc1ccc(cc1)c2nc(no2)c3ccc4c(c3)CCNC4 270196a_100016988750_100000183673 [2,0,0,0,0,0|2,0,0]=4 126 B28R4.2719984 CCCc1ccc(cc1Br)c2nc(no2)c3ccc4c(c3)CCNC4 270196a_100016988750_200010235943 [2,0,0,0,0,0|2,0,0]=4 127 B28R4.2719984 CCOc1ccc(cc1Br)c2nc(no2)c3ccc4c(c3)CCNC4 270196a_100016988750_100000230806 [2,0,0,0,0,0|1,0,0]=3 128 B28R4.2719984 CCOc1ccc(cc1Cl)c2nc(no2)c3ccc4c(c3)CCNC4 270196a_100016988750_100000230665 [2,0,0,0,0,0|1,0,0]=3 129 B28R4.1835807 C#Cc1cc(ccc1CC)c2nc(no2)c3ccc4c(c3)CCNC4 270196a_100016988750_200134618274 [2,0,0,0,0,0|1,0,0]=3 130 B28R4.1835807 COc1ccc(cc1C#N)c2nc(no2)c3ccc4c(c3)CCCN4 270196a_100012279141_100011999887 [2,0,0,0,0,0|2,0,0]=4 131 B28R4.1835807 COc1ccc(cc1C#N)c2nc(no2)c3ccc4c(c3)CCNC4 270196a_100016988750_100011999887 [2,0,0,0,0,0|0,0,0]=2 132 B28R4.1835807 COc1ccc(cc1C#N)c2nc(no2)c3ccc4c(c3)CNCC4 270196a_100000067367_100011999887 [2,0,0,0,0,0|2,0,0]=4 133 B28R4.1835807 COc1ccc(cc1OC)c2nc(no2)c3ccc4c(c3)CCNC4 270196a_100016988750_100000211223 [2,0,0,0,0,0|2,0,0]=4 134 B30R3.2490625 COCCNc1ccc(cc1)c2noc(n2)c3ccc(c(c3)C#N)OC(C)C 270196a_100000237291_100010204700 [0,1,1,0,0,0|2,0,0]=4 135 B30R3.2490625 COCCOc1ccc(cc1)c2noc(n2)c3ccc(c(c3)C#N)OC(C)C 270196a_100000234137_100010204700 [0,1,1,0,0,0|2,0,0]=4 136 B30R3.2528606 CC(=O)OCc1ccc(cc1)c2noc(n2)c3ccc(c(c3)C#N)OC(C)C 270196a_200000000622_100010204700 [0,1,1,0,0,0|1,0,1]=4 137 B30R3.2528619 COC(=O)Cc1ccc(cc1)c2noc(n2)c3ccc(c(c3)C#N)OC(C)C 270196a_100000058082_100010204700 [0,1,1,0,0,0|2,0,0]=4 138 B30R3.10542586 CCOC(=O)c1ccc(cc1)c2noc(n2)c3ccc(c(c3)C#N)OC(C)C 270196a_100000170228_100010204700 [0,1,1,0,0,0|1,0,1]=4 139 B30R3.2528615 CC(=O)OCc1cccc(c1)c2noc(n2)c3ccc(c(c3)C#N)OC(C)C 270196a_200000000586_100010204700 [0,1,1,0,0,0|2,0,0]=4 140 B30R3.14639179 C=CCNCc1cccc(c1)c2noc(n2)c3ccc(c(c3)C#N)OC(C)C 270196a_100000226261_100010204700 [0,1,1,0,0,0|1,0,1]=4 141 B30R3.14639179 COCCOc1cccc(c1)c2noc(n2)c3ccc(c(c3)C#N)OC(C)C 270196a_100000234104_100010204700 [0,1,1,0,0,0|1,0,0]=3 142 B30R3.24001360 COC(=O)Cc1cccc(c1)c2noc(n2)c3ccc(c(c3)C#N)OC(C)C 270196a_100000081101_100010204700 [0,1,1,0,0,0|1,0,1]=4 143 B30R3.122087293 CCOc1cc(ccc1OC)c2noc(n2)c3ccc(c(c3)C#N)OC(C)C 270196a_100000188254_100010204700 [0,1,1,0,0,0|2,0,0]=4 144 B30R3.24001448 COC(=O)c1ccc(cc1C)c2noc(n2)c3ccc(c(c3)C#N)OC(C)C 270196a_100009878264_100010204700 [0,1,1,0,0,0|1,0,1]=4 145 B30R4.224264116 CC(C)Oc1c(cc(cc1F)c2nc(no2)c3ccc4c(c3)CCNC4)F 270196a_100016988750_200011822609 [1,1,0,0,0,0|1,0,0]=3 146 B30R4.224264116 Cc1cc(cc(c1OC(C)C)C)c2nc(no2)c3ccc4c(c3)CCNC4 270196a_100016988750_200011245642 [1,1,0,0,0,0|0,0,1]=3 147 B30R4.2221177 CCCOc1ccc(cc1C#N)c2nc(no2)c3ccc4c(c3)CCCN4 270196a_100012279141_100010428921 [1,1,0,0,0,0|2,0,0]=4 148 B30R4.2221177 CCCOc1ccc(cc1C#N)c2nc(no2)c3ccc4c(c3)CCNC4 270196a_100016988750_100010428921 [1,1,0,0,0,0|0,0,0]=2 149 B30R4.2221177 CCCOc1ccc(cc1C#N)c2nc(no2)c3ccc4c(c3)CNCC4 270196a_100000067367_100010428921 [1,1,0,0,0,0|2,0,0]=4 150 B30R4.2221177 CCCOc1ccc(cc1OC)c2nc(no2)c3ccc4c(c3)CCNC4 270196a_100016988750_100000182800 [1,1,0,0,0,0|2,0,0]=4 151 B30R4.50259261 CCOc1ccc(cc1OCC)c2nc(no2)c3ccc4c(c3)CCNC4 270196a_100016988750_100000189236 [1,1,0,0,0,0|1,0,1]=4 152 B30R4.142731483 CCOc1ccc(cc1C#N)c2nc(no2)c3cc4c([nH]c3=O)CCCC4 270196a_100011292548_100000092412 [1,1,0,0,0,0|2,0,0]=4 153 B30R4.142731483 CCOc1ccc(cc1C#N)c2nc(no2)c3cc4c(nc3Cl)CCCC4 270196a_100000186327_100000092412 [1,1,0,0,0,0|2,0,0]=4 154 B30R4.142732238 CCOc1ccc(cc1C#N)c2nc(no2)c3ccc4c(c3)CCCC4=O 270196a_100000079117_100000092412 [1,1,0,0,0,0|1,0,1]=4 155 B30R4.191220960 CCOc1c(cc(cc1OC)c2nc(no2)c3ccc4c(c3)CCNC4)Br 270196a_100016988750_200000183745 [1,1,0,0,0,0|2,0,0]=4 156 B30R4.12291274 CC(C)Oc1ccc(cc1C#N)c2nc(no2)c3ccc4[nH]ccc4c3F 270196a_100009952160_100010204700 [0,1,0,0,1,0|0,0,2]=4 157 B30R4.12291274 CC(C)Oc1ccc(cc1C#N)c2nc(no2)c3ccc4[nH]ncc4c3Cl 270196a_100000100394_100010204700 [0,1,0,0,1,0|1,0,1]=4 158 B30R4.12291274 CC(C)Oc1ccc(cc1C#N)c2nc(no2)c3ccc4[nH]ncc4c3F 270196a_100000092848_100010204700 [0,1,0,0,1,0|1,0,1]=4 159 B30R4.12291276 CC(C)Oc1ccc(cc1C#N)c2nc(no2)c3ccc4[nH]c(=O)[nH]c4c3 270196a_100000687731_100010204700 [0,1,0,0,1,0|1,0,1]=4 160 B30R4.12291276 CC(C)Oc1ccc(cc1C#N)c2nc(no2)c3ccc4[nH]c(nc4c3)Cl 270196a_100011999131_100010204700 [0,1,0,0,1,0|1,0,1]=4 161 B30R4.12291276 CC(C)Oc1ccc(cc1C#N)c2nc(no2)c3ccc4c(c3)CC(=O)N4 270196a_100000040493_100010204700 [0,1,0,0,1,0|0,0,1]=3 162 B30R4.12291276 CC(C)Oc1ccc(cc1C#N)c2nc(no2)c3ccc4c(c3)NC(=O)C4 270196a_100000040494_100010204700 [0,1,0,0,1,0|1,0,1]=4 163 B30R4.12291276 CC(C)Oc1ccc(cc1C#N)c2nc(no2)c3ccc4cn(nc4c3)C 270196a_100000106854_100010204700 [0,1,0,0,1,0|1,0,1]=4 164 B30R4.12291276 CC(C)Oc1ccc(cc1C#N)c2nc(no2)c3cnc4c(c3)CC(=O)N4 270196a_100009851003_100010204700 [0,1,0,0,1,0|1,0,1]=4 165 B30R4.12291276 CC1Cc2ccc(cc2N1)c3noc(n3)c4ccc(c(c4)C#N)OC(C)C 270196a_100010690488_100010204700 [0,1,0,0,1,0|1,0,0]=3 166 B30R4.65867935 CC(C)Oc1ccc(cc1[N+](=O)[O-])c2nc(no2)c3ccc4c(c3)CCN4 270196a_100011198519_100000244681 [0,1,0,0,1,0|2,0,0]=4 167 B30R4.97319671 CC(C)Oc1ccc(cc1C#N)c2nc(no2)c3cc4cn[nH]c4cc3Cl 270196a_100010762497_100010204700 [0,1,0,0,1,0|1,0,1]=4 168 B30R4.97319671 CC(C)Oc1ccc(cc1C#N)c2nc(no2)c3cc4cn[nH]c4cc3F 270196a_100009846612_100010204700 [0,1,0,0,1,0|1,0,1]=4 169 B30R4.97319671 Cc1cc2[nH]ccc2cc1c3noc(n3)c4ccc(c(c4)C#N)OC(C)C 270196a_100000090446_100010204700 [0,1,0,0,1,0|0,0,2]=4 170 B30R4.97319705 CC(C)Oc1ccc(cc1C#N)c2nc(no2)c3ccc4[nH]nc(c4c3)Br 270196a_200009888970_100010204700 [0,1,0,0,1,0|1,0,1]=4 171 B30R4.97319705 CC(C)Oc1ccc(cc1C#N)c2nc(no2)c3ccc4c(c3)C(=O)CC4 270196a_100000716822_100010204700 [0,1,0,0,1,0|0,0,1]=3 172 B30R4.97319705 CC(C)Oc1ccc(cc1C#N)c2nc(no2)c3ccc4c(c3)C(=O)OC4 270196a_100000080561_100010204700 [0,1,0,0,1,0|1,0,1]=4 173 B30R4.97320059 CC(C)Oc1ccc(cc1C#N)c2nc(no2)c3ccc4c(c3)CCC4=O 270196a_100011998686_100010204700 [0,1,0,0,1,0|0,0,1]=3 174 B30R4.97320059 CC(C)Oc1ccc(cc1C#N)c2nc(no2)c3ccc4c(c3)COC4=O 270196a_100000066514_100010204700 [0,1,0,0,1,0|1,0,1]=4 175 B30R4.97320059 CC(C)Oc1ccc(cc1C#N)c2nc(no2)c3ccc4c(c3)ccn4C 270196a_100011934874_100010204700 [0,1,0,0,1,0|0,0,2]=4 176 B30R4.97320059 CC(C)Oc1ccc(cc1C#N)c2nc(no2)c3ccc4c(c3)cnn4C 270196a_100000070297_100010204700 [0,1,0,0,1,0|1,0,1]=4 177 B30R4.97320059 CC(C)Oc1ccc(cc1C#N)c2nc(no2)c3ccc4c(c3)ncn4C 270196a_100000691488_100010204700 [0,1,0,0,1,0|1,0,1]=4 178 B30R4.97320059 CC(C)Oc1ccc(cc1C#N)c2nc(no2)c3ccc4c(c3)nnn4C 270196a_200000101748_100010204700 [0,1,0,0,1,0|2,0,0]=4 179 B30R4.2049241 COc1cc(ccc1C(C)(C)C)c2nc(no2)c3ccc4c(c3)CCNC4 270196a_100016988750_100000068277 [0,1,0,0,1,0|2,0,0]=4 180 B30R4.46796809 CC(C)c1ccc(cc1[N+](=O)[O-])c2nc(no2)c3ccc4c(c3)CCNC4 270196a_100016988750_100000709017 [0,1,0,0,1,0|2,0,0]=4 181 B32R4.130258269 CC(C)Oc1ccc(cc1C#N)c2nc(no2)c3cc(c4c(c3)OCCCO4)Cl 270196a_100000203702_100010204700 [0,1,0,0,0,1|2,0,0]=4 182 B32R4.7573918 COc1cc(cc(c1OCC(C)C)Cl)c2nc(no2)c3ccc4c(c3)CCNC4 270196a_100016988750_100000261261 [0,1,0,0,0,1|2,0,0]=4 183 B32R4.52896085 CCOc1cc(ccc1OCC(C)C)c2nc(no2)c3ccc4c(c3)CCNC4 270196a_100016988750_100000261130 [0,1,0,0,0,1|1,0,1]=4 184 B32R4.91170978 CC(C)Oc1ccc(cc1C(F)(F)F)c2nc(no2)c3ccc4c(c3)CCNC4 270196a_100016988750_100005743011 [0,2,0,0,0,0|1,0,1]=4 185 B30R4.12291256 CC(C)Oc1ccc(cc1C#N)c2nc(no2)c3ccc(cc3)NC4CC4 270196a_100000218894_100010204700 [0,0,1,1,0,0|2,0,0]=4 186 B30R4.2047051 CC(C)Oc1ccc(cc1C#N)c2nc(no2)c3cccc4c3CCCC4 270196a_100012186132_100010204700 [0,0,1,1,0,0|1,0,0]=3 187 B30R4.2047051 CC(C)Oc1ccc(cc1C#N)c2nc(no2)c3cccc4c3NCCC4 270196a_100000103555_100010204700 [0,0,1,1,0,0|2,0,0]=4 188 B30R4.97319943 CC(C)Oc1ccc(cc1C#N)c2nc(no2)c3cccc4c3n(cc4)C 270196a_100000069933_100010204700 [0,0,1,1,0,0|0,0,2]=4 189 B30R4.97319940 Cc1ccc(c2c1cc[nH]2)c3noc(n3)c4ccc(c(c4)C#N)OC(C)C 270196a_100009883554_100010204700 [0,0,1,1,0,0|0,0,2]=4 190 B30R5.529723805 c1cc2c(cc1c3noc(n3)c4ccc5c(c4)OCCCO5)CCNC2 270196a_100016988750_100000198587 [1,0,0,1,0,0|2,0,0]=4 191 B28R4.2576594 CC(C)Oc1ccc(cc1Br)c2nc(no2)c3ccc4c(c3)CCN4 270196a_100011198519_100000243735 [1,0,0,0,1,0|1,0,0]=3 192 B28R4.2576594 CC(C)Oc1ccc(cc1Br)c2nc(no2)c3ccc4c(c3)CCO4 270196a_100011216889_100000243735 [1,0,0,0,1,0|2,0,0]=4 193 B28R4.2576594 CC(C)Oc1ccc(cc1Cl)c2nc(no2)c3ccc4c(c3)CCN4 270196a_100011198519_100011453123 [1,0,0,0,1,0|1,0,0]=3 194 B28R4.2576594 CC(C)Oc1ccc(cc1Cl)c2nc(no2)c3ccc4c(c3)CCO4 270196a_100011216889_100011453123 [1,0,0,0,1,0|2,0,0]=4 195 B28R4.2576594 CC(C)Oc1ccc(cc1F)c2nc(no2)c3ccc4c(c3)CCN4 270196a_100011198519_200011234205 [1,0,0,0,1,0|1,0,0]=3 196 B28R4.2576594 CC(C)Oc1ccc(cc1F)c2nc(no2)c3ccc4c(c3)CCO4 270196a_100011216889_200011234205 [1,0,0,0,1,0|2,0,0]=4 197 B28R4.2576594 CC(C)Oc1ccc(cc1I)c2nc(no2)c3ccc4c(c3)CCN4 270196a_100011198519_100012355715 [1,0,0,0,1,0|1,0,0]=3 198 B28R4.2576594 CC(C)Oc1ccc(cc1I)c2nc(no2)c3ccc4c(c3)CCO4 270196a_100011216889_100012355715 [1,0,0,0,1,0|2,0,0]=4 199 B28R4.2576594 Cc1cc(ccc1OC(C)C)c2nc(no2)c3ccc4c(c3)CCN4 270196a_100011198519_200011734124 [1,0,0,0,1,0|0,0,1]=3 200 B28R4.2576594 Cc1cc(ccc1OC(C)C)c2nc(no2)c3ccc4c(c3)CCO4 270196a_100011216889_200011734124 [1,0,0,0,1,0|1,0,1]=4 201 B28R4.2578657 CC(C)c1ccc(cc1Br)c2nc(no2)c3ccc4c(c3)CCNC4 270196a_100016988750_100010235942 [1,0,0,0,1,0|1,0,0]=3 202 B28R4.2718357 CCOc1ccc(cc1C#N)c2nc(no2)c3ccc4[nH]ccc4c3 270196a_100000766051_100000092412 [1,0,0,0,1,0|0,0,2]=4 203 B28R4.2718357 CCOc1ccc(cc1C#N)c2nc(no2)c3ccc4[nH]cnc4c3 270196a_100000759558_100000092412 [1,0,0,0,1,0|1,0,1]=4 204 B28R4.2718357 CCOc1ccc(cc1C#N)c2nc(no2)c3ccc4[nH]ncc4c3 270196a_100102524907_100000092412 [1,0,0,0,1,0|1,0,1]=4 205 B28R4.2718357 CCOc1ccc(cc1C#N)c2nc(no2)c3ccc4[nH]nnc4c3 270196a_100000072070_100000092412 [1,0,0,0,1,0|2,0,0]=4 206 B28R4.2718357 CCOc1ccc(cc1C#N)c2nc(no2)c3ccc4c(c3)CCN4 270196a_100011198519_100000092412 [1,0,0,0,1,0|0,0,0]=2 207 B28R4.2718357 CCOc1ccc(cc1C#N)c2nc(no2)c3ccc4c(c3)CCO4 270196a_100011216889_100000092412 [1,0,0,0,1,0|1,0,0]=3 208 B28R4.2718357 CCOc1ccc(cc1C#N)c2nc(no2)c3ccc4c(c3)OCO4 270196a_100000188249_100000092412 [1,0,0,0,1,0|2,0,0]=4 209 B28R4.2718357 CCOc1ccc(cc1OC)c2nc(no2)c3ccc4c(c3)CCN4 270196a_100011198519_100000184834 [1,0,0,0,1,0|2,0,0]=4 210 B30R4.50259742 CCOc1ccc(cc1OC)Cc2nc(no2)c3ccc4c(c3)CCNC4 270196a_100016988750_100000061229 [1,0,0,0,0,1|2,0,0]=4 211 B30R4.2047066 CC(C)Oc1ccc(cc1C#N)c2nc(no2)Cc3ccc4[nH]ccc4c3 270196a_100000092285_100010204700 [0,0,0,0,1,1|0,0,2]=4 212 B30R4.2047066 CC(C)Oc1ccc(cc1C#N)c2nc(no2)Cc3ccc4c(c3)OCO4 270196a_100000735443_100010204700 [0,0,0,0,1,1|2,0,0]=4 213 B30R4.12414138 COc1cc(ccc1OC(C)C)Cc2nc(no2)c3ccc4c(c3)CCN4 270196a_100011198519_100010294056 [0,0,0,0,1,1|2,0,0]=4 214 B30R4.66478281 COc1cc(ccc1OCC(C)C)c2nc(no2)c3ccc4c(c3)CCN4 270196a_100011198519_100000182899 [0,0,0,0,1,1|2,0,0]=4 215 B30R4.15281964 COc1ccc(cc1OC(C)C)c2nc(no2)c3ccc4c(c3)CCNC4 270196a_100016988750_100011217381 [0,0,0,0,1,1|2,0,0]=4 216 B32R4.97195221 COc1cc(ccc1OCCC(C)C)c2nc(no2)c3ccc4c(c3)CCNC4 270196a_100016988750_100000260990 [0,0,0,0,0,2|2,0,0]=4