0 B16R2.2244 Cc1ccc(cn1)CN2CCCC2C#N 2230a_100000701862_100016987292 [1,0,0,0,0,0|2,0,1]=4 1 B16R2.2244 Cc1ccc(cn1)CN2CCC[C@@H]2C#N 2230a_106645074975_100016987292 [1,0,0,0,0,0|2,0,1]=4 2 B16R2.2244 Cc1ccc(cn1)CN2CCC[C@@H]2C#N 269982a_106645074975_100016987292 [1,0,0,0,0,0|2,0,1]=4 3 B16R2.2244 Cc1ccc(cn1)CN2CCC[C@@H]2C#N 270004a_106645074975_100000743784 [1,0,0,0,0,0|2,0,1]=4 4 B16R2.2244 N#CC1CCCN1Cc2ccc(cc2)Cl 2230a_100000701862_100000694040 [1,0,0,0,0,0|2,0,1]=4 5 B16R2.2244 N#CC1CCCN1Cc2ccc(nc2)Br 2230a_100000701862_100009831999 [1,0,0,0,0,0|1,1,1]=4 6 B16R2.2244 N#CC1CCCN1Cc2ccc(nc2)Cl 2230a_100000701862_100000735431 [1,0,0,0,0,0|1,0,1]=3 7 B16R2.2244 N#CC1CCCN1Cc2ccc(nc2)F 2230a_100000701862_100009820150 [1,0,0,0,0,0|1,1,1]=4 8 B16R2.2244 N#CC1CCCN1Cc2ccc(nn2)Cl 2230a_100000701862_100016992710 [1,0,0,0,0,0|2,0,1]=4 9 B16R2.2244 N#C[C@H]1CCCN1Cc2ccc(cc2)Cl 2230a_106645074975_100000694040 [1,0,0,0,0,0|2,0,1]=4 10 B16R2.2244 N#C[C@H]1CCCN1Cc2ccc(cc2)Cl 269982a_106645074975_100000187161 [1,0,0,0,0,0|2,0,1]=4 11 B16R2.2244 N#C[C@H]1CCCN1Cc2ccc(cc2)Cl 270004a_106645074975_100000189385 [1,0,0,0,0,0|2,0,1]=4 12 B16R2.2244 N#C[C@H]1CCCN1Cc2ccc(nc2)Br 2230a_106645074975_100009831999 [1,0,0,0,0,0|1,1,1]=4 13 B16R2.2244 N#C[C@H]1CCCN1Cc2ccc(nc2)Br 269982a_106645074975_100009831999 [1,0,0,0,0,0|1,1,1]=4 14 B16R2.2244 N#C[C@H]1CCCN1Cc2ccc(nc2)Cl 2230a_106645074975_100000735431 [1,0,0,0,0,0|1,0,1]=3 15 B16R2.2244 N#C[C@H]1CCCN1Cc2ccc(nc2)Cl 269982a_106645074975_100000735431 [1,0,0,0,0,0|1,0,1]=3 16 B16R2.2244 N#C[C@H]1CCCN1Cc2ccc(nc2)F 2230a_106645074975_100009820150 [1,0,0,0,0,0|1,1,1]=4 17 B16R2.2244 N#C[C@H]1CCCN1Cc2ccc(nc2)F 269982a_106645074975_100009820150 [1,0,0,0,0,0|1,1,1]=4 18 B16R2.2244 N#C[C@H]1CCCN1Cc2ccc(nn2)Cl 2230a_106645074975_100016992710 [1,0,0,0,0,0|2,0,1]=4 19 B16R2.2244 N#C[C@H]1CCCN1Cc2ccc(nn2)Cl 270004a_106645074975_100000044651 [1,0,0,0,0,0|2,0,1]=4 20 B16R2.2244 N#C[C@H]1CCCN1Cc2cnc(cn2)Cl 270004a_106645074975_100012001714 [1,0,0,0,0,0|2,0,1]=4 21 B16R1.6 N#CCCCCCNCc1ccc(nc1)Cl 2230a_100000735879_100009813376 [0,0,1,0,0,0|2,0,1]=4 22 B16R1.743 CCN(Cc1ccc(cc1)Cl)C(=O)CC#N 1626a_100000180830_100051588842 [0,0,1,0,0,0|2,1,0]=4 23 B16R1.743 CCN(Cc1ccc(cc1)Cl)C(=O)CC#N 240690a_100000180830_100051588842 [0,0,1,0,0,0|2,1,0]=4 24 B16R1.1267 CCCN(CCC#N)Cc1ccc(nc1)Cl 2230a_100000176855_100000735431 [0,0,1,0,0,0|2,0,1]=4 25 B18R2.112 N#CCC1CCCCN1Cc2ccc(nc2)Cl 2230a_100000133382_100000735431 [0,0,0,0,0,1|2,0,1]=4 26 B18R2.112 N#CCC1CCCCN1Cc2ccc(nc2)Cl 34a_100000133382_100000735431 [0,0,0,0,0,1|2,0,1]=4 27 B18R2.189 N#CCC1CCCN(C1)Cc2ccc(nc2)Cl 2230a_100015183952_100000735431 [0,0,0,0,0,1|2,0,1]=4 28 B18R2.189 N#CCC1CCCN(C1)Cc2ccc(nc2)Cl 34a_100015183952_100000735431 [0,0,0,0,0,1|2,0,1]=4 29 B15R1.12 N#CCCCCNCc1ccc(nc1)Cl 2230a_100000735879_100000211819 [1,0,1,0,0,0|1,0,1]=4 30 B15R1.12 N#CCOCCNCc1ccc(nc1)Cl 2230a_100000735879_200000047693 [1,0,1,0,0,0|0,1,1]=4 31 B15R1.48 CC(CC#N)N(C)Cc1ccc(nc1)Cl 2230a_100000026953_100009813641 [1,0,1,0,0,0|1,0,1]=4 32 B15R1.48 CC(CC#N)N(C)Cc1ccc(nc1)Cl 269982a_100000026953_100009813641 [1,0,1,0,0,0|1,0,1]=4 33 B15R1.48 CN(Cc1ccc(nc1)Cl)C(=O)CC#N 240690a_100000026953_100051588842 [1,0,1,0,0,0|1,1,0]=4 34 B15R1.564 CCN(CCC#N)Cc1ccc(nc1)Cl 2230a_100000226048_100000735431 [1,0,1,0,0,0|1,0,1]=4 35 B15R1.640 CCN(Cc1cccnc1)C(=O)CC#N 1626a_100000186920_100051588842 [1,0,1,0,0,0|1,1,0]=4 36 B15R1.640 CCN(Cc1cccnc1)C(=O)CC#N 240690a_100000186920_100051588842 [1,0,1,0,0,0|1,1,0]=4 37 B15R1.1285 CC[C@H](CC#N)NCc1ccc(nc1)Cl 2230a_200009818565_100000735431 [1,0,1,0,0,0|1,0,1]=4 38 B15R2.118 N#CC1CCCN1Cc2cccnc2 2230a_100000701862_100000741622 [2,0,0,0,0,0|1,0,1]=4 39 B15R2.118 N#C[C@H]1CCCN1Cc2cccnc2 2230a_106645074975_100000741622 [2,0,0,0,0,0|1,0,1]=4 40 B15R2.118 N#C[C@H]1CCCN1Cc2cccnc2 269982a_106645074975_100000733263 [2,0,0,0,0,0|1,0,1]=4 41 B15R2.118 N#C[C@H]1CCCN1Cc2cccnc2 270004a_106645074975_100000209961 [2,0,0,0,0,0|1,0,1]=4 42 B15R2.1510 CC1SCCN1Cc2ccc(nc2)Cl 2230a_200011216479_100000735431 [2,0,0,0,0,0|0,0,2]=4 43 B15R2.1510 CC1SCCN1Cc2ccc(nc2)Cl 269982a_200011216479_100000735431 [2,0,0,0,0,0|0,0,2]=4 44 B15R2.1510 CC1SCCN1Cc2ccc(nc2)Cl 34a_200011216479_100000735431 [2,0,0,0,0,0|0,0,2]=4 45 B17R1.21042 CC(C)N(Cc1ccc(nc1)Cl)C(=O)CC#N 1626a_100016992178_100051588842 [0,1,1,0,0,0|1,1,0]=4 46 B17R1.21042 CC(C)N(Cc1ccc(nc1)Cl)C(=O)CC#N 240690a_100016992178_100051588842 [0,1,1,0,0,0|1,1,0]=4 47 B17R2.1282 N#CC1CCCN1Cc2ccc(nc2Cl)Cl 2230a_100000701862_100000722033 [1,1,0,0,0,0|1,0,1]=4 48 B17R2.1282 N#CC1CCCN1Cc2cnc(cc2Cl)Cl 2230a_100000701862_100011997056 [1,1,0,0,0,0|1,0,1]=4 49 B17R2.1282 N#C[C@H]1CCCN1Cc2ccc(nc2Cl)Cl 2230a_106645074975_100000722033 [1,1,0,0,0,0|1,0,1]=4 50 B17R2.1282 N#C[C@H]1CCCN1Cc2ccc(nc2Cl)Cl 269982a_106645074975_100000722033 [1,1,0,0,0,0|1,0,1]=4 51 B17R2.1282 N#C[C@H]1CCCN1Cc2cnc(cc2Br)Cl 270004a_106645074975_100009892795 [1,1,0,0,0,0|1,0,1]=4 52 B17R2.1282 N#C[C@H]1CCCN1Cc2cnc(cc2Cl)Cl 2230a_106645074975_100011997056 [1,1,0,0,0,0|1,0,1]=4 53 B17R2.1282 N#C[C@H]1CCCN1Cc2cnc(cc2Cl)Cl 269982a_106645074975_100011997056 [1,1,0,0,0,0|1,0,1]=4 54 B17R2.1295 Cc1cc(cnc1Cl)CN2CCC[C@@H]2C#N 270004a_106645074975_100000070293 [1,1,0,0,0,0|1,0,1]=4 55 B17R2.1295 N#CC1CCCN1Cc2cnc(c(c2)Cl)Cl 2230a_100000701862_100009843750 [1,1,0,0,0,0|1,0,1]=4 56 B17R2.1295 N#CC1CCCN1Cc2cnc(c(c2)I)Cl 2230a_100000701862_100011072623 [1,1,0,0,0,0|1,0,1]=4 57 B17R2.1295 N#C[C@H]1CCCN1Cc2cnc(c(c2)Cl)Cl 2230a_106645074975_100009843750 [1,1,0,0,0,0|1,0,1]=4 58 B17R2.1295 N#C[C@H]1CCCN1Cc2cnc(c(c2)Cl)Cl 269982a_106645074975_100009843750 [1,1,0,0,0,0|1,0,1]=4 59 B17R2.1295 N#C[C@H]1CCCN1Cc2cnc(c(c2)F)Cl 270004a_106645074975_100009866847 [1,1,0,0,0,0|1,0,1]=4 60 B17R2.1295 N#C[C@H]1CCCN1Cc2cnc(c(c2)I)Cl 2230a_106645074975_100011072623 [1,1,0,0,0,0|1,0,1]=4 61 B17R2.1295 N#C[C@H]1CCCN1Cc2cnc(c(c2)I)Cl 269982a_106645074975_100011072623 [1,1,0,0,0,0|1,0,1]=4 62 B17R2.2573 N#C[C@@H]1C[C@@H](CN1Cc2ccc(nc2)Cl)F 2230a_100020587076_100000735431 [1,1,0,0,0,0|1,0,1]=4 63 B17R2.2573 N#C[C@@H]1C[C@@H](CN1Cc2ccc(nc2)Cl)F 34a_100020587076_100000735431 [1,1,0,0,0,0|1,0,1]=4 64 B17R2.49831 N#CCC(=O)N1CCc2nc(ccc2C1)Cl 1626a_100015190003_100051588842 [0,0,1,1,0,0|1,1,0]=4 65 B17R2.49831 N#CCC(=O)N1CCc2nc(ccc2C1)Cl 240690a_100015190003_100051588842 [0,0,1,1,0,0|1,1,0]=4