0 B27R3.52606788 CCOC(=O)c1ccc(nc1)CSc2ccc3c(c2)C(CCN3)(C)C 62a_100015196883_100016987449 [0,0,0,0,0,0|2,0,1]=3 1 B27R3.52606788 CCOC(=O)c1ccc(nc1)CSc2ccc3c(c2)C(CCN3)(C)C 62a_100016987449_100015196883 [0,0,0,0,0,0|2,0,1]=3 2 B26R3.5074436 CCOC(=O)c1ccc(nc1)CSc2ccc3c(c2)C(CCN3)C 62a_100015196883_200013856564 [1,0,0,0,0,0|2,0,1]=4 3 B26R3.5074436 CCOC(=O)c1ccc(nc1)CSc2ccc3c(c2)C(CCN3)C 62a_200013856564_100015196883 [1,0,0,0,0,0|2,0,1]=4 4 B26R3.5074436 CCOC(=O)c1ccc(nc1)CSc2ccc3c(c2)C(CCS3)N 62a_100000744474_100015196883 [1,0,0,0,0,0|2,0,1]=4 5 B26R3.5074436 CCOC(=O)c1ccc(nc1)CSc2ccc3c(c2)C(CCS3)N 62a_100015196883_100000744474 [1,0,0,0,0,0|2,0,1]=4 6 B26R3.54668635 COC(=O)c1ccc(nc1)CSc2ccc3c(c2)C(CCN3)(C)C 62a_100010230174_100016987449 [1,0,0,0,0,0|2,0,1]=4 7 B26R3.54668635 COC(=O)c1ccc(nc1)CSc2ccc3c(c2)C(CCN3)(C)C 62a_100016987449_100010230174 [1,0,0,0,0,0|2,0,1]=4 8 B26R3.54668635 COC(=O)c1ccc(nc1)CSc2ccc3c(c2)C(CCS3)(C)C 62a_100010194334_100010230174 [1,0,0,0,0,0|1,0,1]=3 9 B26R3.54668635 COC(=O)c1ccc(nc1)CSc2ccc3c(c2)C(CCS3)(C)C 62a_100010230174_100010194334 [1,0,0,0,0,0|1,0,1]=3 10 B26R3.54668635 COC(=O)c1cnc(cn1)CSc2ccc3c(c2)C(CCS3)(C)C 62a_100010194334_200010203303 [1,0,0,0,0,0|2,0,1]=4 11 B26R3.54668635 COC(=O)c1cnc(cn1)CSc2ccc3c(c2)C(CCS3)(C)C 62a_200010203303_100010194334 [1,0,0,0,0,0|2,0,1]=4 12 B26R2.26374149 CCOC(=O)c1ccc(nc1)COc2ccc(c(c2)C(C)(C)C)OC 34a_100000074442_100015196883 [0,0,1,0,0,0|1,1,1]=4 13 B26R2.26374149 CCOC(=O)c1ccc(nc1)COc2ccc(c(c2)C(C)(C)C)OC 7a_100000074442_100015196883 [0,0,1,0,0,0|1,1,1]=4 14 B26R3.46368435 CCNC(=O)c1ccc(nc1)Sc2ccc3c(c2)C(CCN3)(C)C 62a_100000160145_100016987449 [0,0,0,0,1,0|3,0,0]=4 15 B26R3.46368435 CCNC(=O)c1ccc(nc1)Sc2ccc3c(c2)C(CCN3)(C)C 62a_100016987449_100000160145 [0,0,0,0,1,0|3,0,0]=4 16 B26R3.46368435 CCNC(=O)c1ccc(nc1)Sc2ccc3c(c2)C(CCS3)(C)C 62a_100000160145_100010194334 [0,0,0,0,1,0|2,0,0]=3 17 B26R3.46368435 CCNC(=O)c1ccc(nc1)Sc2ccc3c(c2)C(CCS3)(C)C 62a_100010194334_100000160145 [0,0,0,0,1,0|2,0,0]=3 18 B26R3.46368435 CCOC(=O)c1ccc(nc1)Sc2ccc3c(c2)C(CCN3)(C)C 62a_100011291635_100016987449 [0,0,0,0,1,0|2,0,0]=3 19 B26R3.46368435 CCOC(=O)c1ccc(nc1)Sc2ccc3c(c2)C(CCN3)(C)C 62a_100016987449_100000170224 [0,0,0,0,1,0|2,0,0]=3 20 B26R3.46368435 CCOC(=O)c1ccc(nn1)Sc2ccc3c(c2)C(CCN3)(C)C 62a_100016987449_100011933454 [0,0,0,0,1,0|3,0,0]=4 21 B26R3.46368435 CCOC(=O)c1ccc(nn1)Sc2ccc3c(c2)C(CCS3)(C)C 62a_100010194334_100011933454 [0,0,0,0,1,0|2,0,0]=3 22 B26R3.46368435 CCOC(=O)c1cnc(cn1)Sc2ccc3c(c2)C(CCN3)(C)C 62a_100000707868_100016987449 [0,0,0,0,1,0|3,0,0]=4 23 B26R3.46368435 CCOC(=O)c1cnc(cn1)Sc2ccc3c(c2)C(CCN3)(C)C 62a_100016987449_100000707868 [0,0,0,0,1,0|3,0,0]=4 24 B26R3.46368435 CCOC(=O)c1cnc(cn1)Sc2ccc3c(c2)C(CCS3)(C)C 62a_100000707868_100010194334 [0,0,0,0,1,0|2,0,0]=3 25 B26R3.46368435 CCOC(=O)c1cnc(cn1)Sc2ccc3c(c2)C(CCS3)(C)C 62a_100010194334_100000707868 [0,0,0,0,1,0|2,0,0]=3 26 B26R3.46368435 CCOC(=O)c1cnc(nc1)Sc2ccc3c(c2)C(CCN3)(C)C 62a_100016987449_100011935661 [0,0,0,0,1,0|3,0,0]=4 27 B26R3.46368435 CCOC(=O)c1cnc(nc1)Sc2ccc3c(c2)C(CCS3)(C)C 62a_100010194334_100011935661 [0,0,0,0,1,0|2,0,0]=3 28 B26R3.46376771 CCOC(=O)c1ccc(nc1)CSc2ccc3c(c2)C(CN3)(C)C 62a_100000756796_100015196883 [0,0,0,0,1,0|2,0,1]=4 29 B26R3.46376771 CCOC(=O)c1ccc(nc1)CSc2ccc3c(c2)C(CN3)(C)C 62a_100015196883_100000756796 [0,0,0,0,1,0|2,0,1]=4 30 B25R2.1250482 COC(=O)c1ccc(cc1)C#Cc2ccc(cc2)SCCC(C)O 62a_100012276601_206454646287 [1,0,1,0,0,0|2,0,0]=4 31 B25R2.1250482 COC(=O)c1ccc(cc1)C#Cc2ccc(cc2)SCOC(C)C 62a_100000709892_206454646287 [1,0,1,0,0,0|2,0,0]=4 32 B27R3.53783921 CCOC(=O)c1cnc(c(c1)O)Sc2ccc3c(c2)C(CCN3)(C)C 62a_100016987449_100010179890 [0,1,0,0,1,0|2,0,0]=4 33 B27R3.53783921 CCOC(=O)c1cnc(c(c1)O)Sc2ccc3c(c2)C(CCS3)(C)C 62a_100010194334_100010179890 [0,1,0,0,1,0|1,0,0]=3 34 B27R3.339461782 CCOC(=O)c1ccc(nc1C)Sc2ccc3c(c2)C(CCN3)(C)C 62a_100000106303_100016987449 [0,1,0,0,1,0|2,0,0]=4 35 B27R3.339461782 CCOC(=O)c1ccc(nc1C)Sc2ccc3c(c2)C(CCN3)(C)C 62a_100016987449_100000106303 [0,1,0,0,1,0|2,0,0]=4 36 B27R3.339461782 CCOC(=O)c1cnc(cc1N)Sc2ccc3c(c2)C(CCN3)(C)C 62a_100009998224_100016987449 [0,1,0,0,1,0|2,0,0]=4 37 B27R3.339461782 CCOC(=O)c1cnc(cc1N)Sc2ccc3c(c2)C(CCN3)(C)C 62a_100016987449_100009998224 [0,1,0,0,1,0|2,0,0]=4 38 B27R3.339461782 CCOC(=O)c1cnc(cc1N)Sc2ccc3c(c2)C(CCS3)(C)C 62a_100009998224_100010194334 [0,1,0,0,1,0|1,0,0]=3 39 B27R3.339461782 CCOC(=O)c1cnc(cc1N)Sc2ccc3c(c2)C(CCS3)(C)C 62a_100010194334_100009998224 [0,1,0,0,1,0|1,0,0]=3 40 B27R3.339461782 CCOC(=O)c1cnc(nc1C)Sc2ccc3c(c2)C(CCS3)(C)C 62a_100000693866_100010194334 [0,1,0,0,1,0|2,0,0]=4 41 B27R3.339461782 CCOC(=O)c1cnc(nc1C)Sc2ccc3c(c2)C(CCS3)(C)C 62a_100010194334_100000693866 [0,1,0,0,1,0|2,0,0]=4 42 B27R3.339461782 CCOC(=O)c1cnc(nc1N)Sc2ccc3c(c2)C(CCS3)(C)C 62a_100010194334_100010210812 [0,1,0,0,1,0|2,0,0]=4 43 B27R3.339461782 CCOC(=O)c1cnc(nc1N)Sc2ccc3c(c2)C(CCS3)(C)C 62a_100010210812_100010194334 [0,1,0,0,1,0|2,0,0]=4 44 B27R3.339461782 CCOC(=O)c1ncc(nc1N)Sc2ccc3c(c2)C(CCS3)(C)C 62a_100010194334_100010729991 [0,1,0,0,1,0|2,0,0]=4 45 B27R3.339461782 CCOC(=O)c1ncc(nc1N)Sc2ccc3c(c2)C(CCS3)(C)C 62a_100010729991_100010194334 [0,1,0,0,1,0|2,0,0]=4 46 B27R4.132277432 CC1(CCSc2c1cc(cc2)Sc3ccc4c(n3)CCNC4=O)C 62a_100009858568_100010194334 [0,0,0,1,1,0|2,0,0]=4 47 B27R4.132277432 CC1(CCSc2c1cc(cc2)Sc3ccc4c(n3)CCNC4=O)C 62a_100010194334_100009858568 [0,0,0,1,1,0|2,0,0]=4 48 B25R2.22925 CCOC(=O)c1ccc(nn1)Sc2ccc(cc2)SCCC(C)C 62a_200009813137_100011933454 [0,0,1,0,1,0|2,0,0]=4 49 B25R2.22925 CCOC(=O)c1cnc(cn1)Sc2ccc(cc2)SCCC(C)C 62a_100000707868_200009813137 [0,0,1,0,1,0|2,0,0]=4 50 B25R2.22925 CCOC(=O)c1cnc(cn1)Sc2ccc(cc2)SCCC(C)C 62a_200009813137_100000707868 [0,0,1,0,1,0|2,0,0]=4 51 B25R2.22925 CCOC(=O)c1cnc(nc1)Sc2ccc(cc2)SCCC(C)C 62a_200009813137_100011935661 [0,0,1,0,1,0|2,0,0]=4 52 B25R3.346707 CCOC(=O)c1ccc(nc1)Sc2ccc3c(c2)C(CCN3)C 62a_100011291635_200013856564 [1,0,0,0,1,0|2,0,0]=4 53 B25R3.346707 CCOC(=O)c1ccc(nc1)Sc2ccc3c(c2)C(CCN3)C 62a_200013856564_100000170224 [1,0,0,0,1,0|2,0,0]=4 54 B25R3.346707 CCOC(=O)c1ccc(nc1)Sc2ccc3c(c2)C(CCS3)N 62a_100000744474_100000170224 [1,0,0,0,1,0|2,0,0]=4 55 B25R3.346707 CCOC(=O)c1ccc(nc1)Sc2ccc3c(c2)C(CCS3)N 62a_100011291635_100000744474 [1,0,0,0,1,0|2,0,0]=4 56 B25R3.44117388 CNC(=O)c1ccc(nc1)Sc2ccc3c(c2)C(CCS3)(C)C 62a_100000159860_100010194334 [1,0,0,0,1,0|2,0,0]=4 57 B25R3.44117388 CNC(=O)c1ccc(nc1)Sc2ccc3c(c2)C(CCS3)(C)C 62a_100010194334_100000159860 [1,0,0,0,1,0|2,0,0]=4 58 B25R3.44117388 COC(=O)c1ccc(nc1)Sc2ccc3c(c2)C(CCN3)(C)C 62a_100000733799_100016987449 [1,0,0,0,1,0|2,0,0]=4 59 B25R3.44117388 COC(=O)c1ccc(nc1)Sc2ccc3c(c2)C(CCN3)(C)C 62a_100016987449_100000733799 [1,0,0,0,1,0|2,0,0]=4 60 B25R3.44117388 COC(=O)c1ccc(nc1)Sc2ccc3c(c2)C(CCS3)(C)C 62a_100000733799_100010194334 [1,0,0,0,1,0|1,0,0]=3 61 B25R3.44117388 COC(=O)c1ccc(nc1)Sc2ccc3c(c2)C(CCS3)(C)C 62a_100010194334_100000733799 [1,0,0,0,1,0|1,0,0]=3 62 B25R3.44117388 COC(=O)c1ccc(nn1)Sc2ccc3c(c2)C(CCS3)(C)C 62a_100000738951_100010194334 [1,0,0,0,1,0|2,0,0]=4 63 B25R3.44117388 COC(=O)c1ccc(nn1)Sc2ccc3c(c2)C(CCS3)(C)C 62a_100010194334_100000738951 [1,0,0,0,1,0|2,0,0]=4 64 B25R3.44117388 COC(=O)c1cnc(cn1)Sc2ccc3c(c2)C(CCS3)(C)C 62a_100010194334_100010219404 [1,0,0,0,1,0|2,0,0]=4 65 B25R3.44117388 COC(=O)c1cnc(cn1)Sc2ccc3c(c2)C(CCS3)(C)C 62a_100010219404_100010194334 [1,0,0,0,1,0|2,0,0]=4 66 B25R3.44117388 COC(=O)c1cnc(nc1)Sc2ccc3c(c2)C(CCS3)(C)C 62a_100000729365_100010194334 [1,0,0,0,1,0|2,0,0]=4 67 B25R3.44117388 COC(=O)c1cnc(nc1)Sc2ccc3c(c2)C(CCS3)(C)C 62a_100010194334_100000729365 [1,0,0,0,1,0|2,0,0]=4 68 B25R3.37250300 CCOC(=O)c1c[nH]c(n1)Sc2ccc3c(c2)C(CCS3)(C)C 62a_100010194334_100010231773 [0,0,0,0,2,0|2,0,0]=4 69 B25R3.37250300 CCOC(=O)c1c[nH]c(n1)Sc2ccc3c(c2)C(CCS3)(C)C 62a_100010231773_100010194334 [0,0,0,0,2,0|2,0,0]=4 70 B25R3.37250300 CCOC(=O)c1cc(no1)Sc2ccc3c(c2)C(CCS3)(C)C 62a_100010138273_100010194334 [0,0,0,0,2,0|2,0,0]=4 71 B25R3.37250300 CCOC(=O)c1cc(no1)Sc2ccc3c(c2)C(CCS3)(C)C 62a_100010194334_100010138273 [0,0,0,0,2,0|2,0,0]=4 72 B25R3.37250300 CCOC(=O)c1cnc(o1)Sc2ccc3c(c2)C(CCS3)(C)C 62a_100010194334_100010205802 [0,0,0,0,2,0|2,0,0]=4 73 B25R3.37250300 CCOC(=O)c1coc(n1)Sc2ccc3c(c2)C(CCS3)(C)C 62a_100010194334_100011935043 [0,0,0,0,2,0|2,0,0]=4 74 B25R3.37250300 CCOC(=O)c1coc(n1)Sc2ccc3c(c2)C(CCS3)(C)C 62a_100011935043_100010194334 [0,0,0,0,2,0|2,0,0]=4 75 B25R3.346938 CCNC(=O)c1ccc(cc1)c2ccc3c(c2)C(CCS3)(C)C 271570a_200000043865_100010194334 [0,0,0,0,2,0|2,0,0]=4 76 B25R3.346938 CCOC(=O)c1ccc(cc1)c2ccc3c(c2)C(CCN3)(C)C 271570a_100000043864_100016987449 [0,0,0,0,2,0|2,0,0]=4 77 B25R3.346938 CCOC(=O)c1ccc(cn1)c2ccc3c(c2)C(CCS3)(C)C 271570a_100010168231_100010194334 [0,0,0,0,2,0|2,0,0]=4 78 B25R3.37295671 CCOC(=O)c1ccc(nc1)Sc2ccc3c(c2)C(CN3)(C)C 62a_100000756796_100000170224 [0,0,0,0,2,0|2,0,0]=4 79 B25R3.37295671 CCOC(=O)c1ccc(nc1)Sc2ccc3c(c2)C(CN3)(C)C 62a_100011291635_100000756796 [0,0,0,0,2,0|2,0,0]=4 80 B27R3.78792411 CCOC(=O)Cc1ccc(nc1)Sc2ccc3c(c2)C(CCN3)(C)C 62a_100000071673_100016987449 [0,0,0,0,1,1|2,0,0]=4 81 B27R3.78792411 CCOC(=O)Cc1ccc(nc1)Sc2ccc3c(c2)C(CCN3)(C)C 62a_100016987449_100000071673 [0,0,0,0,1,1|2,0,0]=4