0 B29R4.26027717 CCOc1ccc(cc1C#N)c2nc(no2)c3cccc4c3CCC4=O 270196a_100011996346_100000092412 [0,0,0,0,0,0|0,0,2]=2 1 B29R4.26027717 CCOc1ccc(cc1C#N)c2nc(no2)c3cccc4c3[nH]nc4Br 270196a_100010245458_100000092412 [0,0,0,0,0,0|3,0,1]=4 2 B29R4.26027717 CCOc1ccc(cc1C#N)c2nc(no2)c3cccc4c3ccn4C 270196a_100011934858_100000092412 [0,0,0,0,0,0|2,0,2]=4 3 B29R4.26027717 CCOc1ccc(cc1OC)c2nc(no2)c3cccc4c3CCC4=O 270196a_100011996346_100000184834 [0,0,0,0,0,0|2,0,2]=4 4 B28R4.9309242 C#Cc1cc(ccc1CC)c2nc(no2)c3cccc4c3CCC4=O 270196a_100011996346_200134618274 [1,0,0,0,0,0|1,0,2]=4 5 B28R4.9309242 COc1ccc(cc1C#N)c2nc(no2)c3cccc4c3CCC4=O 270196a_100011996346_100011999887 [1,0,0,0,0,0|0,0,2]=3 6 B28R4.18556030 CCOc1ccc(cc1C#N)c2nc(no2)c3cccc4c3NCC4 270196a_100000078505_100000092412 [1,0,0,0,0,0|1,0,0]=2 7 B28R4.18556030 CCOc1ccc(cc1C#N)c2nc(no2)c3cccc4c3[nH]cc4 270196a_100000076704_100000092412 [1,0,0,0,0,0|1,0,2]=4 8 B28R4.18556030 CCOc1ccc(cc1C#N)c2nc(no2)c3cccc4c3[nH]cn4 270196a_100012025332_100000092412 [1,0,0,0,0,0|2,0,1]=4 9 B28R4.18556030 CCOc1ccc(cc1C#N)c2nc(no2)c3cccc4c3[nH]nc4 270196a_100000099555_100000092412 [1,0,0,0,0,0|2,0,1]=4 10 B28R4.18556030 CCOc1ccc(cc1C#N)c2nc(no2)c3cccc4c3cc[nH]4 270196a_100000692599_100000092412 [1,0,0,0,0,0|1,0,2]=4 11 B28R4.18556030 CCOc1ccc(cc1C#N)c2nc(no2)c3cccc4c3cco4 270196a_100000100152_100000092412 [1,0,0,0,0,0|1,0,2]=4 12 B28R4.18556030 CCOc1ccc(cc1C#N)c2nc(no2)c3cccc4c3cn[nH]4 270196a_100000057181_100000092412 [1,0,0,0,0,0|2,0,1]=4 13 B28R4.18556030 CCOc1ccc(cc1C#N)c2nc(no2)c3cccc4c3non4 270196a_100025703077_100000092412 [1,0,0,0,0,0|3,0,0]=4 14 B28R4.18556030 CCOc1ccc(cc1OC)c2nc(no2)c3cccc4c3NCC4 270196a_100000078505_100000184834 [1,0,0,0,0,0|3,0,0]=4 15 B28R4.18572490 CCOc1ccc(cc1Br)c2nc(no2)c3cccc4c3CCC4=O 270196a_100011996346_100000230806 [1,0,0,0,0,0|1,0,2]=4 16 B28R4.18572490 CCOc1ccc(cc1Cl)c2nc(no2)c3cccc4c3CCC4=O 270196a_100011996346_100000230665 [1,0,0,0,0,0|1,0,2]=4 17 B30R4.12291282 CC(C)Oc1ccc(cc1C#N)c2nc(no2)c3cccc4c3CCC4=O 270196a_100011996346_100010204700 [0,1,0,0,0,0|0,0,2]=3 18 B30R4.13844488 CCCOc1ccc(cc1C#N)c2nc(no2)c3cccc4c3CCC4=O 270196a_100011996346_100010428921 [0,1,0,0,0,0|0,0,2]=3 19 B28R3.3218586 CCOc1ccc(cc1C#N)c2nc(no2)c3cccc(c3)C(=O)NC 270196a_100000159956_100000092412 [0,0,1,0,0,0|1,0,2]=4 20 B28R3.3218586 CCOc1ccc(cc1C#N)c2nc(no2)c3cccc(c3)C(=O)OC 270196a_100000151112_100000092412 [0,0,1,0,0,0|1,0,2]=4 21 B28R3.3218590 CCOc1ccc(cc1C#N)c2nc(no2)c3cccc(c3C)[N+](=O)[O-] 270196a_100011999439_100000092412 [0,0,1,0,0,0|2,0,1]=4 22 B28R3.7385725 C#CCOc1ccccc1c2noc(n2)c3ccc(c(c3)C#N)OCC 270196a_100000172685_100000092412 [0,0,1,0,0,0|2,0,1]=4 23 B28R3.7385725 CCCNc1ccccc1c2noc(n2)c3ccc(c(c3)C#N)OCC 270196a_200000219117_100000092412 [0,0,1,0,0,0|2,0,0]=3 24 B28R3.7385725 CCCOc1ccccc1c2noc(n2)c3ccc(c(c3)C#N)OCC 270196a_200000170523_100000092412 [0,0,1,0,0,0|2,0,0]=3 25 B28R3.7385725 CCOc1ccc(cc1C#N)c2nc(no2)c3cccnc3NCCO 270196a_100000156395_100000092412 [0,0,1,0,0,0|2,0,0]=3 26 B28R3.27039160 CCOc1ccc(cc1C#N)c2nc(no2)c3cccc(c3OC)OC 270196a_100000189342_100000092412 [0,0,1,0,0,0|3,0,0]=4 27 B30R4.21986973 CCOc1ccc(cc1C#N)c2nc(no2)c3cccc4c3nccc4O 270196a_200000087321_100000092412 [0,0,0,0,0,1|0,0,3]=4 28 B27R3.2924545 CCOc1ccc(cc1C#N)c2nc(no2)c3cccc(c3)C(=O)C 270196a_100000738961_100000092412 [1,0,1,0,0,0|0,0,2]=4 29 B27R3.2924545 CCOc1ccc(cc1C#N)c2nc(no2)c3cccc(c3)C(F)F 270196a_100000708296_100000092412 [1,0,1,0,0,0|2,0,0]=4 30 B27R3.2924545 CCOc1ccc(cc1C#N)c2nc(no2)c3cccc(c3)N(C)C 270196a_200011525604_100000092412 [1,0,1,0,0,0|2,0,0]=4 31 B27R3.2924545 CCOc1ccc(cc1C#N)c2nc(no2)c3cccc(n3)C(C)C 270196a_200009859122_100000092412 [1,0,1,0,0,0|2,0,0]=4 32 B27R3.2924545 CCOc1ccc(cc1C#N)c2nc(no2)c3ccnc(c3)C(C)C 270196a_100009846975_100000092412 [1,0,1,0,0,0|2,0,0]=4 33 B27R3.5204612 CCCc1cc(ccn1)c2noc(n2)c3ccc(c(c3)C#N)OCC 270196a_100000094184_100000092412 [1,0,1,0,0,0|1,0,0]=3 34 B27R3.5204612 CCNc1cccc(c1)c2noc(n2)c3ccc(c(c3)C#N)OCC 270196a_100000221300_100000092412 [1,0,1,0,0,0|1,0,0]=3 35 B27R3.5204612 CCOc1ccc(cc1C#N)c2nc(no2)c3cccc(c3)CCO 270196a_100012001419_100000092412 [1,0,1,0,0,0|1,0,0]=3 36 B27R3.5204612 CCOc1ccc(cc1C#N)c2nc(no2)c3cccc(c3)CNC 270196a_100000168042_100000092412 [1,0,1,0,0,0|1,0,0]=3 37 B27R3.5204612 CCOc1ccc(cc1C#N)c2nc(no2)c3cccc(c3)CSC 270196a_100000750944_100000092412 [1,0,1,0,0,0|1,0,0]=3 38 B27R3.5204612 CCOc1cccc(c1)c2noc(n2)c3ccc(c(c3)C#N)OCC 270196a_100000172519_100000092412 [1,0,1,0,0,0|1,0,0]=3 39 B27R3.2924546 CCOc1ccc(cc1C#N)c2nc(no2)c3cccc(c3C)C=O 270196a_200009888290_100000092412 [1,0,1,0,0,0|0,0,2]=4 40 B27R3.2924546 CCOc1ccc(cc1C#N)c2nc(no2)c3cccc(c3Cl)OC 270196a_100000068444_100000092412 [1,0,1,0,0,0|2,0,0]=4 41 B27R3.2924546 CCOc1ccc(cc1C#N)c2nc(no2)c3cccc(c3F)CO 270196a_100012181476_100000092412 [1,0,1,0,0,0|1,0,0]=3 42 B27R3.2924546 CCOc1ccc(cc1C#N)c2nc(no2)c3cccc(c3F)OC 270196a_100000094592_100000092412 [1,0,1,0,0,0|2,0,0]=4 43 B27R3.2924546 CCOc1ccc(cc1C#N)c2nc(no2)c3cccc(c3O)OC 270196a_100011934230_100000092412 [1,0,1,0,0,0|2,0,0]=4 44 B27R3.3888349 CCNc1ccccc1c2noc(n2)c3ccc(c(c3)C#N)OCC 270196a_200000218880_100000092412 [1,0,1,0,0,0|1,0,0]=3 45 B27R3.3888349 CCNc1ncccc1c2noc(n2)c3ccc(c(c3)C#N)OCC 270196a_100000156588_100000092412 [1,0,1,0,0,0|2,0,0]=4 46 B27R3.3888349 CCOc1ccc(cc1C#N)c2nc(no2)c3ccccc3CNC 270196a_100000225633_100000092412 [1,0,1,0,0,0|1,0,0]=3 47 B27R3.3888349 CCOc1ccc(cc1C#N)c2nc(no2)c3ccccc3OCC 270196a_100000170521_100000092412 [1,0,1,0,0,0|1,0,0]=3 48 B27R3.3888349 CCOc1ccc(cc1C#N)c2nc(no2)c3cccnc3OCC 270196a_100000736856_100000092412 [1,0,1,0,0,0|2,0,0]=4 49 B27R3.5969561 CCCNc1ccccc1c2noc(n2)c3ccc(c(c3)C#N)OC 270196a_200000219117_100011999887 [1,0,1,0,0,0|2,0,0]=4 50 B27R3.5969561 CCCOc1ccccc1c2noc(n2)c3ccc(c(c3)C#N)OC 270196a_200000170523_100011999887 [1,0,1,0,0,0|2,0,0]=4 51 B27R3.5969561 COc1ccc(cc1C#N)c2nc(no2)c3cccnc3NCCO 270196a_100000156395_100011999887 [1,0,1,0,0,0|2,0,0]=4 52 B27R3.2924544 CCOc1ccc(cc1C#N)c2nc(no2)c3cccc(c3OC)Br 270196a_100009817008_100000092412 [1,0,1,0,0,0|2,0,0]=4 53 B27R3.2924544 CCOc1ccc(cc1C#N)c2nc(no2)c3cccc(c3OC)F 270196a_100000061658_100000092412 [1,0,1,0,0,0|2,0,0]=4 54 B27R3.2924544 CCOc1ccc(cc1C#N)c2nc(no2)c3cccc(c3OC)O 270196a_200009874251_100000092412 [1,0,1,0,0,0|1,0,0]=3 55 B27R4.7124423 C#Cc1cc(ccc1CC)c2nc(no2)c3cccc4c3NCC4 270196a_100000078505_200134618274 [2,0,0,0,0,0|2,0,0]=4 56 B27R4.7124423 COc1ccc(cc1C#N)c2nc(no2)c3cccc4c3NCC4 270196a_100000078505_100011999887 [2,0,0,0,0,0|1,0,0]=3 57 B27R4.13574277 CCOc1ccc(cc1Br)c2nc(no2)c3cccc4c3NCC4 270196a_100000078505_100000230806 [2,0,0,0,0,0|2,0,0]=4 58 B27R4.13574277 CCOc1ccc(cc1Cl)c2nc(no2)c3cccc4c3NCC4 270196a_100000078505_100000230665 [2,0,0,0,0,0|2,0,0]=4 59 B27R4.1665848 CCOc1ccc(cc1)c2nc(no2)c3cccc4c3CCC4=O 270196a_100011996346_100000181891 [2,0,0,0,0,0|0,0,2]=4 60 B29R3.3490711 CCOc1ccc(cc1C#N)c2nc(no2)c3cccc(c3)C(OC)OC 270196a_200015684075_100000092412 [0,1,1,0,0,0|1,0,0]=3 61 B29R3.37476524 CCNC(=O)c1cccc(c1)c2noc(n2)c3ccc(c(c3)C#N)OCC 270196a_100000160228_100000092412 [0,1,1,0,0,0|0,0,2]=4 62 B29R3.37476524 CCOC(=O)c1cccc(c1)c2noc(n2)c3ccc(c(c3)C#N)OCC 270196a_100000171449_100000092412 [0,1,1,0,0,0|0,0,2]=4 63 B29R3.3490710 CCOc1ccc(cc1C#N)c2nc(no2)c3cccc(c3O)C(C)(C)C 270196a_100009886286_100000092412 [0,1,1,0,0,0|2,0,0]=4 64 B29R3.9322255 CC(C)Oc1ccc(cc1C#N)c2nc(no2)c3cccnc3NCCO 270196a_100000156395_100010204700 [0,1,1,0,0,0|2,0,0]=4 65 B29R3.9322255 CCCNc1ccccc1c2noc(n2)c3ccc(c(c3)C#N)OC(C)C 270196a_200000219117_100010204700 [0,1,1,0,0,0|2,0,0]=4 66 B29R3.9322255 CCCOc1ccccc1c2noc(n2)c3ccc(c(c3)C#N)OC(C)C 270196a_200000170523_100010204700 [0,1,1,0,0,0|2,0,0]=4 67 B29R3.9322276 CCCNc1ccccc1c2noc(n2)c3ccc(c(c3)C#N)OCCC 270196a_200000219117_100010428921 [0,1,1,0,0,0|2,0,0]=4 68 B29R3.9322276 CCCOc1ccc(cc1C#N)c2nc(no2)c3ccccc3OCCC 270196a_200000170523_100010428921 [0,1,1,0,0,0|2,0,0]=4 69 B29R3.9322276 CCCOc1ccc(cc1C#N)c2nc(no2)c3cccnc3NCCO 270196a_100000156395_100010428921 [0,1,1,0,0,0|2,0,0]=4 70 B29R3.10641121 CCOc1ccc(cc1C#N)c2nc(no2)c3ccc(cc3OCCO)Br 270196a_200013764850_100000092412 [0,1,1,0,0,0|1,0,0]=3 71 B29R3.94724129 CCCCNc1ccccc1c2noc(n2)c3ccc(c(c3)C#N)OCC 270196a_200000219028_100000092412 [0,1,1,0,0,0|1,0,0]=3 72 B29R3.94724129 CCCCNc1ncccc1c2noc(n2)c3ccc(c(c3)C#N)OCC 270196a_200000156426_100000092412 [0,1,1,0,0,0|2,0,0]=4 73 B29R3.94724129 CCOc1ccc(cc1C#N)c2nc(no2)c3ccccc3OCCOC 270196a_200000234126_100000092412 [0,1,1,0,0,0|1,0,0]=3 74 B29R4.155639993 COc1ccc(c(c1C#N)F)c2nc(no2)c3cccc4c3CCC4=O 270196a_100011996346_200009924707 [1,1,0,0,0,0|0,0,2]=4 75 B29R4.13902893 CC(C)Oc1ccc(cc1C#N)c2nc(no2)c3cccc4c3NCC4 270196a_100000078505_100010204700 [1,1,0,0,0,0|1,0,0]=3 76 B29R4.15536615 CCCOc1ccc(cc1C#N)c2nc(no2)c3cccc4c3NCC4 270196a_100000078505_100010428921 [1,1,0,0,0,0|1,0,0]=3 77 B29R4.207193520 CCOc1ccc(cc1C#N)c2nc(no2)c3cccc4c3CC(=O)N4 270196a_100010268631_100000092412 [1,1,0,0,0,0|1,0,1]=4 78 B29R4.207193171 CCOc1ccc(cc1C#N)c2nc(no2)c3ccc4c(c3)C(=O)CC4 270196a_100000716822_100000092412 [0,0,1,1,0,0|0,0,2]=4 79 B29R4.3068899 CCOc1ccc(cc1C#N)c2nc(no2)c3cccc4c3CCCC4 270196a_100012186132_100000092412 [0,0,1,1,0,0|1,0,0]=3 80 B29R4.3068899 CCOc1ccc(cc1C#N)c2nc(no2)c3cccc4c3NCCC4 270196a_100000103555_100000092412 [0,0,1,1,0,0|2,0,0]=4 81 B29R4.3068899 CCOc1ccc(cc1C#N)c2nc(no2)c3cccc4c3OCCO4 270196a_200011794367_100000092412 [0,0,1,1,0,0|1,0,0]=3 82 B29R3.37476516 CCOc1ccc(cc1C#N)c2nc(no2)c3cccc(c3)NC(=O)CC 270196a_100000152059_100000092412 [0,0,1,0,0,1|0,0,2]=4