0 B21R2.358778 CC(C)(C)C(Cn1ccnc1)NCc2ccc(cc2)Br 207a_100000740554_100000186029 [1,0,0,0,0,0|2,1,0]=4 1 B21R2.358778 CC(C)(C)C(Cn1ccnc1)NCc2ccc(cc2)Br 2230a_100000740554_100011217064 [1,0,0,0,0,0|2,1,0]=4 2 B21R2.358778 CC(C)(C)C(Cn1ccnc1)NCc2ccc(cc2)Br 270004a_100000740554_100000186029 [1,0,0,0,0,0|2,1,0]=4 3 B21R2.358778 CC(C)(C)C(Cn1ccnc1)NCc2ccc(cc2)Cl 207a_100000740554_100000189385 [1,0,0,0,0,0|2,0,0]=3 4 B21R2.358778 CC(C)(C)C(Cn1ccnc1)NCc2ccc(cc2)Cl 2230a_100000740554_100000694040 [1,0,0,0,0,0|2,0,0]=3 5 B21R2.358778 CC(C)(C)C(Cn1ccnc1)NCc2ccc(cc2)Cl 270004a_100000740554_100000189385 [1,0,0,0,0,0|2,0,0]=3 6 B21R2.358778 CC(C)(C)C(Cn1ccnc1)NCc2ccc(cc2)F 207a_100000740554_100000210084 [1,0,0,0,0,0|2,1,0]=4 7 B21R2.358778 CC(C)(C)C(Cn1ccnc1)NCc2ccc(cc2)F 2230a_100000740554_100000198546 [1,0,0,0,0,0|2,1,0]=4 8 B21R2.358778 CC(C)(C)C(Cn1ccnc1)NCc2ccc(cc2)F 270004a_100000740554_100000210084 [1,0,0,0,0,0|2,1,0]=4 9 B21R2.358778 CC(C)(C)C(Cn1ccnc1)NCc2ccc(cc2)I 207a_100000740554_100000188517 [1,0,0,0,0,0|2,1,0]=4 10 B21R2.358778 CC(C)(C)C(Cn1ccnc1)NCc2ccc(cc2)I 2230a_100000740554_100000189116 [1,0,0,0,0,0|2,1,0]=4 11 B21R2.358778 CC(C)(C)C(Cn1ccnc1)NCc2ccc(cn2)Cl 207a_100000740554_100011361569 [1,0,0,0,0,0|3,0,0]=4 12 B21R2.358778 CC(C)(C)C(Cn1ccnc1)NCc2ccc(cn2)Cl 2230a_100000740554_100012066911 [1,0,0,0,0,0|3,0,0]=4 13 B21R2.358778 CC(C)(C)C(Cn1ccnc1)NCc2ccc(cn2)Cl 270004a_100000740554_100011361569 [1,0,0,0,0,0|3,0,0]=4 14 B21R2.358778 CC(C)(C)C(Cn1ccnc1)NCc2ccc(nc2)Cl 2230a_100000740554_100000735431 [1,0,0,0,0,0|3,0,0]=4 15 B21R2.358778 Cc1ccc(cc1)CNC(Cn2ccnc2)C(C)(C)C 207a_100000740554_100000211033 [1,0,0,0,0,0|3,0,0]=4 16 B21R2.358778 Cc1ccc(cc1)CNC(Cn2ccnc2)C(C)(C)C 2230a_100000740554_100000210814 [1,0,0,0,0,0|3,0,0]=4 17 B21R2.358778 Cc1ccc(cc1)CNC(Cn2ccnc2)C(C)(C)C 270004a_100000740554_100000211033 [1,0,0,0,0,0|3,0,0]=4 18 B23R2.19175405 CC(C)(C)C(CCc1ccc(cc1)Cl)(Cn2cncn2)O[13CH3] 7a_100020606157_200025704644 [0,1,0,0,0,0|0,0,0]=1 19 B23R2.19175405 COC(CCc1ccc(cc1)Cl)(Cn2cncn2)C(C)(C)C 7a_100020606157_200000210301 [0,1,0,0,0,0|0,0,0]=1 20 B20R2.235863 CC(C)C(Cn1ccnc1)NCc2ccc(cc2)Cl 207a_100020605144_100000189385 [2,0,0,0,0,0|2,0,0]=4 21 B20R2.235863 CC(C)C(Cn1ccnc1)NCc2ccc(cc2)Cl 270004a_100020605144_100000189385 [2,0,0,0,0,0|2,0,0]=4 22 B20R2.2282842 CC(C)(C)C(Cn1ccnc1)NCc2ccccc2 207a_100000740554_100015611070 [2,0,0,0,0,0|2,0,0]=4 23 B20R2.2282842 CC(C)(C)C(Cn1ccnc1)NCc2ccccc2 2230a_100000740554_100015291786 [2,0,0,0,0,0|2,0,0]=4 24 B20R2.2282842 CC(C)(C)C(Cn1ccnc1)NCc2ccccc2 270004a_100000740554_100015611070 [2,0,0,0,0,0|2,0,0]=4 25 B22R2.519036 CC(NC(Cn1ccnc1)C(C)(C)C)c2ccc(cc2)Cl 2230a_100000740554_100000684792 [1,1,0,0,0,0|2,0,0]=4 26 B22R2.519036 CC(NC(Cn1ccnc1)C(C)(C)C)c2ccc(cc2)Cl 269862a_100000740554_100000185797 [1,1,0,0,0,0|2,0,0]=4 27 B22R2.523328 CC(C)(C)C(Cn1ccnc1)NCc2ccc(c(c2)Br)Cl 207a_100000740554_100000693810 [1,1,0,0,0,0|2,0,0]=4 28 B22R2.523328 CC(C)(C)C(Cn1ccnc1)NCc2ccc(c(c2)Br)Cl 2230a_100000740554_100012353894 [1,1,0,0,0,0|2,0,0]=4 29 B22R2.523328 CC(C)(C)C(Cn1ccnc1)NCc2ccc(c(c2)Br)Cl 270004a_100000740554_100000693810 [1,1,0,0,0,0|2,0,0]=4 30 B22R2.523328 CC(C)(C)C(Cn1ccnc1)NCc2ccc(c(c2)Cl)Cl 207a_100000740554_100000188533 [1,1,0,0,0,0|2,0,0]=4 31 B22R2.523328 CC(C)(C)C(Cn1ccnc1)NCc2ccc(c(c2)Cl)Cl 2230a_100000740554_100000184707 [1,1,0,0,0,0|2,0,0]=4 32 B22R2.523328 CC(C)(C)C(Cn1ccnc1)NCc2ccc(c(c2)Cl)Cl 270004a_100000740554_100000188533 [1,1,0,0,0,0|2,0,0]=4 33 B22R2.523328 CC(C)(C)C(Cn1ccnc1)NCc2ccc(c(c2)F)Cl 207a_100000740554_100000745630 [1,1,0,0,0,0|2,0,0]=4 34 B22R2.523328 CC(C)(C)C(Cn1ccnc1)NCc2ccc(c(c2)F)Cl 2230a_100000740554_100000716492 [1,1,0,0,0,0|2,0,0]=4 35 B22R2.523328 CC(C)(C)C(Cn1ccnc1)NCc2ccc(c(c2)F)Cl 270004a_100000740554_100000745630 [1,1,0,0,0,0|2,0,0]=4 36 B22R2.523328 CC(C)(C)C(Cn1ccnc1)NCc2ccc(c(c2)I)Cl 207a_100000740554_100010209939 [1,1,0,0,0,0|2,0,0]=4 37 B22R2.523328 CC(C)(C)C(Cn1ccnc1)NCc2ccc(c(c2)I)Cl 270004a_100000740554_100010209939 [1,1,0,0,0,0|2,0,0]=4 38 B22R2.523328 Cc1cc(ccc1Cl)CNC(Cn2ccnc2)C(C)(C)C 207a_100000740554_100000698814 [1,1,0,0,0,0|2,0,0]=4 39 B22R2.523328 Cc1cc(ccc1Cl)CNC(Cn2ccnc2)C(C)(C)C 2230a_100000740554_100012184735 [1,1,0,0,0,0|2,0,0]=4 40 B22R2.523328 Cc1cc(ccc1Cl)CNC(Cn2ccnc2)C(C)(C)C 270004a_100000740554_100000698814 [1,1,0,0,0,0|2,0,0]=4 41 B22R2.4079349 CC(C)(C)C(Cn1ccnc1)NCc2ccc(cc2Br)Cl 207a_100000740554_100000687667 [1,1,0,0,0,0|2,0,0]=4 42 B22R2.4079349 CC(C)(C)C(Cn1ccnc1)NCc2ccc(cc2Br)Cl 2230a_100000740554_100000755608 [1,1,0,0,0,0|2,0,0]=4 43 B22R2.4079349 CC(C)(C)C(Cn1ccnc1)NCc2ccc(cc2Br)Cl 270004a_100000740554_100000687667 [1,1,0,0,0,0|2,0,0]=4 44 B22R2.4079349 CC(C)(C)C(Cn1ccnc1)NCc2ccc(cc2Cl)Cl 207a_100000740554_100000188887 [1,1,0,0,0,0|2,0,0]=4 45 B22R2.4079349 CC(C)(C)C(Cn1ccnc1)NCc2ccc(cc2Cl)Cl 2230a_100000740554_100000188473 [1,1,0,0,0,0|2,0,0]=4 46 B22R2.4079349 CC(C)(C)C(Cn1ccnc1)NCc2ccc(cc2Cl)Cl 270004a_100000740554_100000188887 [1,1,0,0,0,0|2,0,0]=4 47 B22R2.4079349 CC(C)(C)C(Cn1ccnc1)NCc2ccc(cc2F)Cl 207a_100000740554_100000697372 [1,1,0,0,0,0|2,0,0]=4 48 B22R2.4079349 CC(C)(C)C(Cn1ccnc1)NCc2ccc(cc2F)Cl 2230a_100000740554_100000709361 [1,1,0,0,0,0|2,0,0]=4 49 B22R2.4079349 CC(C)(C)C(Cn1ccnc1)NCc2ccc(cc2F)Cl 270004a_100000740554_100000697372 [1,1,0,0,0,0|2,0,0]=4 50 B22R2.4079349 CC(C)(C)C(Cn1ccnc1)NCc2ccc(cc2I)Cl 2230a_100000740554_100010254388 [1,1,0,0,0,0|2,0,0]=4 51 B22R2.4079349 Cc1cc(ccc1CNC(Cn2ccnc2)C(C)(C)C)Cl 207a_100000740554_100000766358 [1,1,0,0,0,0|2,0,0]=4 52 B22R2.4079349 Cc1cc(ccc1CNC(Cn2ccnc2)C(C)(C)C)Cl 2230a_100000740554_100012361307 [1,1,0,0,0,0|2,0,0]=4 53 B22R2.4079349 Cc1cc(ccc1CNC(Cn2ccnc2)C(C)(C)C)Cl 270004a_100000740554_100000766358 [1,1,0,0,0,0|2,0,0]=4 54 B24R2.92978367 CC(C)(C)C(CCc1ccc(cc1)Cl)(Cn2cncn2)OCF 7a_100020606157_100015361967 [0,2,0,0,0,0|0,0,0]=2 55 B24R2.92978367 CCOC(CCc1ccc(cc1)Cl)(Cn2cncn2)C(C)(C)C 7a_100020606157_100000210202 [0,2,0,0,0,0|0,0,0]=2 56 B20R2.235857 CC(C)(C)N(Cc1ccc(cc1)Br)Cn2cncn2 2230a_100000189139_200020645497 [1,0,0,0,1,0|1,1,0]=4 57 B20R2.235857 CC(C)(C)N(Cc1ccc(cc1)Br)Cn2cncn2 269982a_100000189139_200020645497 [1,0,0,0,1,0|1,1,0]=4 58 B20R2.235857 CC(C)(C)N(Cc1ccc(cc1)F)Cn2cncn2 2230a_100000180843_200020645497 [1,0,0,0,1,0|1,1,0]=4 59 B20R2.235857 CC(C)(C)N(Cc1ccc(cc1)F)Cn2cncn2 269982a_100000180843_200020645497 [1,0,0,0,1,0|1,1,0]=4 60 B20R2.235857 CC(C)(C)N(Cc1ccc(cc1)F)Cn2cncn2 34a_100000180843_200020645497 [1,0,0,0,1,0|1,1,0]=4 61 B20R2.235857 CC(C)(C)N(Cc1ccc(cc1)O)Cn2cncn2 269982a_100000744446_200020645497 [1,0,0,0,1,0|2,0,0]=4 62 B20R2.235857 Cc1ccc(cc1)CN(Cn2cncn2)C(C)(C)C 2230a_114901603718_200020645497 [1,0,0,0,1,0|2,0,0]=4 63 B20R2.235857 Cc1ccc(cc1)CN(Cn2cncn2)C(C)(C)C 269982a_114901603718_200020645497 [1,0,0,0,1,0|2,0,0]=4 64 B22R2.519513 CC(C)(C)C(Cn1ccnc1)NCCc2ccc(cc2)Br 2230a_100000740554_100011740612 [1,0,0,0,0,1|1,1,0]=4 65 B22R2.519513 CC(C)(C)C(Cn1ccnc1)NCCc2ccc(cc2)Cl 2230a_100000740554_100011713675 [1,0,0,0,0,1|1,0,0]=3 66 B22R2.519513 CC(C)(C)C(Cn1ccnc1)NCCc2ccc(cc2)F 2230a_100000740554_100011217392 [1,0,0,0,0,1|1,1,0]=4 67 B22R2.519513 CC(C)(C)C(Cn1ccnc1)NCCc2ccc(cc2)O 2230a_100000740554_100009816426 [1,0,0,0,0,1|2,0,0]=4 68 B22R2.519513 Cc1ccc(cc1)CCNC(Cn2ccnc2)C(C)(C)C 2230a_100000740554_100011713686 [1,0,0,0,0,1|2,0,0]=4 69 B22R2.8293823 CC(C)(C)OC(CCc1ccc(cc1)Cl)Cn2ccnc2 34a_200016989609_100000210625 [1,0,0,0,0,1|1,0,0]=3