Compound,SMILES,BCL6 TR-FRET Geo Mean IC50 uM,BCL6 TR-FRET pIC50 mean,BCL6 TR-FRET (pIC50) sd,BCL6 TR-FRET (pIC50) sem,BCL6 TR-FRET n,BCL6 NanoBRET Geo Mean IC50 uM,BCL6 NanoBRET pIC50 mean,BCL6 NanoBRET (pIC50) sd,BCL6 NanoBRET (pIC50) sem,BCL6 NanoBRET n,HAC,MoKa LOGP,HBA,HBD,ROT_BOND,TPSA
1,CN1C(=O)N(C)c2cc(ccc21)Nc1ccnc(c1C#N)Cl,3.265888359,5.485998665,0.239903439,0.090674977,7,38.75472143,4.411675381,0.042375642,0.029964104,2,22,2.4,6,1,2,75.64
2,CN1C(=O)C=Cc2cc(ccc21)Nc1ccnc(c1C#N)Cl,2.721682709,5.565162506,0.233108997,0.116554499,4,,,,,,22,2.7,5,1,2,70.71
8a,CN(C)C1=CC(=O)Nc2ccc(cc21)Nc1ccnc(c1C#N)Cl,5.567044062,5.254375341,0.098049676,0.056609007,3,,,,,,24,2.2,5,2,3,84.81
8b,Clc1nccc(c1C#N)Nc1ccc2c(c1)C(=CC(=O)N2)N1CCCCC1,1.176315337,5.929476241,0.238567116,0.106690458,5,,,,,,27,3.1,5,2,3,84.81
8c,CN1CCN(CC1)C1=CC(=O)Nc2ccc(cc21)Nc1ccnc(c1C#N)Cl,2.642605135,5.577967725,0.237700326,0.106302818,5,,,,,,28,1.9,6,2,3,88.05
8d,Clc1nccc(c1C#N)Nc1ccc2c(c1)C(=CC(=O)N2)N1CCOCC1,2.125879568,5.672461342,0.10266242,0.04591203,5,,,,,,27,1.8,6,2,3,94.04
8e,Cn1cc(cn1)C1=CC(=O)Nc2ccc(cc21)Nc1ccnc(c1C#N)Cl,1.823802824,5.739022116,0.112438309,0.079505891,2,,,,,,27,2.2,6,2,3,99.39
8f,CCNC1=CC(=O)Nc2ccc(cc21)Nc1ccnc(c1C#N)Cl,1.310198835,5.882662791,0.179135779,0.073131876,6,,,,,,24,2.4,5,3,4,93.6
11a,CCNC1=CC(=O)N(C)c2ccc(cc21)Nc1cc(nc(c1C#N)Cl)C(=O)O,0.90137987,6.045092145,0.055369953,0.024762196,5,,,,,,28,3,7,3,5,120.04
11b,CCCNC1=CC(=O)N(C)c2ccc(cc21)Nc1cc(nc(c1C#N)Cl)C(=O)O,1.505808109,5.822230368,0.056923706,0.028461853,4,,,,,,29,3.5,7,3,6,120.04
11c,CN1C(=O)C=C(NCCF)c2cc(ccc21)Nc1cc(nc(c1C#N)Cl)C(=O)O,0.877525755,6.056740128,0.00513918,0.002967107,3,,,,,,29,2.6,7,3,6,120.04
11d,CN1C(=O)C=C(NCC2CC2)c2cc(ccc21)Nc1cc(nc(c1C#N)Cl)C(=O)O,0.345670901,6.461337178,0.07613302,0.03806651,4,,,,,,30,3.4,7,3,6,120.04
12a,CNC(=O)C(C)NC1=CC(=O)Nc2ccc(cc21)Nc1ccnc(c1C#N)Cl,0.55246118,6.257698233,0.07165872,0.021605917,11,,,,,,28,1.6,6,4,5,122.7
12b,CNC(=O)[C@@H](C)NC1=CC(=O)Nc2ccc(cc21)Nc1ccnc(c1C#N)Cl,0.253340023,6.596296194,0.071464328,0.027010977,7,,,,,,28,1.6,6,4,5,122.7
12c,CNC(=O)[C@H](C)NC1=CC(=O)Nc2ccc(cc21)Nc1ccnc(c1C#N)Cl,2.667243376,5.573937355,0.14384744,0.054369222,7,,,,,,28,1.6,6,4,5,122.7
12d,CNC(=O)C(NC1=CC(=O)Nc2ccc(cc21)Nc1ccnc(c1C#N)Cl)C1CC1,1.07988996,5.966620496,0.041605842,0.024021144,3,,,,,,30,2,6,4,6,122.7
12e,CNC(=O)CNC1=CC(=O)Nc2ccc(cc21)Nc1ccnc(c1C#N)Cl,23.81455276,4.62315757,0.310557128,0.13888537,5,,,,,,27,1.2,6,4,5,122.7
13a,CNC(=O)C(C)NC1=CC(=O)N(C)c2ccc(cc21)Nc1ccnc(c1C#N)Cl,0.794612254,6.099844742,0.101052146,0.035727329,8,,,,,,29,1.8,7,3,5,111.84
13b,CC(NC1=CC(=O)N(C)c2ccc(cc21)Nc1ccnc(c1C#N)Cl)c1ncco1,1.053961671,5.977175182,0.161366483,0.072165285,5,,,,,,30,2.1,8,2,5,108.77
13c,CC(NC1=CC(=O)N(C)c2ccc(cc21)Nc1ccnc(c1C#N)Cl)c1nnc(o1)C,0.872129569,6.059418989,0.108598533,0.04856674,5,,,,,,31,1.5,9,2,5,121.66
13d,CC(NC1=CC(=O)N(C)c2ccc(cc21)Nc1ccnc(c1C#N)Cl)c1ncn(n1)C,0.199362108,6.700357383,0.268037096,0.154751289,3,,,,,,31,1.5,9,2,5,113.45
13e,CC(NC1=CC(=O)N(C)c2ccc(cc21)Nc1ccnc(c1C#N)Cl)c1ncccn1,0.137543917,6.86155861,0.106688084,0.035562695,9,1.208387022,5.917793948,0.083380573,0.027793524,9,31,2,8,2,5,108.52
13f,C[C@@H](NC1=CC(=O)N(C)c2ccc(cc21)Nc1ccnc(c1C#N)Cl)c1ncccn1,0.082276365,7.084724902,0.056712858,0.032743184,3,1.492479919,5.826091504,0.20592535,0.118891056,3,31,2,8,2,5,108.52
17a,CC(NC1=CC(=O)N(CC2CC2)c2ccc(cc21)Nc1ccnc(c1C#N)Cl)c1ncccn1,0.418123642,6.378695276,0.272379659,0.157258469,3,4.782277647,5.320365213,0.203411546,0.117439711,3,34,2.9,8,2,7,108.52
17b,CC(NC1=CC(=O)N(CC2CCC2)c2ccc(cc21)Nc1ccnc(c1C#N)Cl)c1ncccn1,0.32428299,6.489075832,0.259720786,0.149949865,3,2.099471703,5.677889974,0.341341216,0.197073443,3,35,3.3,8,2,7,108.52
24a,CC(NC1=CC(=O)N(C)c2ccc(cc21)Nc1ccnc(c1C#N)Cl)c1ncc(cn1)C,0.073130561,7.135901093,0.089661052,0.051765832,3,1.075999703,5.968187849,0.000456643,0.000322896,2,32,2.6,8,2,5,108.52
24b,CC(NC1=CC(=O)N(C)c2ccc(cc21)Nc1ccnc(c1C#N)Cl)c1ncc(cn1)C1CC1,0.053902482,7.268391233,0.031900375,0.01841769,3,1.115542193,5.952513999,0.115193492,0.066506993,3,34,3,8,2,6,108.52
13g,CN1C(=O)C=C(NC(C)(C)c2ncccn2)c2cc(ccc21)Nc1ccnc(c1C#N)Cl,0.046407883,7.333408242,0.202627922,0.082722503,6,0.465211922,6.332349164,0.179274317,0.103504075,3,32,2,8,2,5,108.52
25,CN1C(=O)C=C(NC(C)(C)c2ncc(cn2)C2CC2)c2cc(ccc21)Nc1ccnc(c1C#N)Cl,0.02613828,7.582722986,0.160537755,0.071794667,5,0.567836099,6.245777002,0.071268408,0.035634204,4,35,3,8,2,6,108.52