0 B24R1.18298 CCCCCCCCc1ccc(cc1)CCNCCCS(=O)(=O)C 2230a_100000742409_100016989816 [0,0,0,0,0,0|2,0,1]=3 1 B24R1.18298 CCCCCCCCc1ccc(cc1)CCNCCCS(=O)(=O)C 34a_100000742409_100016989816 [0,0,0,0,0,0|2,0,1]=3 2 B24R1.18298 CCCCCCCCc1ccc(cc1)CCNCCNS(=O)(=O)C 34a_100000752411_100016989816 [0,0,0,0,0,0|3,0,1]=4 3 B24R1.18298 CCCCCCCCc1ccc(cc1)CCOCCCS(=O)(=O)C 34a_100000689940_100016989816 [0,0,0,0,0,0|3,0,1]=4 4 B24R1.18298 CCCCCCCCc1ccc(cc1)CCOCCCS(=O)(=O)C 34a_200016989815_100000754308 [0,0,0,0,0,0|3,0,1]=4 5 B24R1.18298 CCCCCCCCc1ccc(cc1)CCOCCCS(=O)(=O)C 7a_100000689940_100016989816 [0,0,0,0,0,0|3,0,1]=4 6 B24R1.18298 CCCCCCCCc1ccc(cc1)CCOCCCS(=O)(=O)C 7a_200016989815_100000754308 [0,0,0,0,0,0|3,0,1]=4 7 B24R1.18298 CCCCCCCCc1ccc(cc1)CCOCCCS(=O)(=O)N 34a_200016989815_100000750626 [0,0,0,0,0,0|3,0,1]=4 8 B24R1.18298 CCCCCCCCc1ccc(cc1)CCOCCCS(=O)(=O)N 7a_200016989815_100000750626 [0,0,0,0,0,0|3,0,1]=4 9 B24R1.18298 CCCCCCCCc1ccc(cc1)CCOCCCS(=O)(=O)[O-] 34a_200016989815_100009813499 [0,0,0,0,0,0|2,0,2]=4 10 B24R1.18298 CCCCCCCCc1ccc(cc1)CCSCCCS(=O)(=O)N 62a_100000750626_100016989816 [0,0,0,0,0,0|3,0,1]=4 11 B24R1.18298 CCCCCCCCc1ccc(cc1)CCSCCCS(=O)(=O)N 62a_100016989816_100000750626 [0,0,0,0,0,0|3,0,1]=4 12 B24R1.18298 CCCCCCCCc1ccc(cc1)CCSCCCS(=O)(=O)[O-] 62a_100009813499_100016989816 [0,0,0,0,0,0|2,0,2]=4 13 B24R1.18298 CCCCCCCCc1ccc(cc1)CCSCCCS(=O)(=O)[O-] 62a_100016989816_100009813499 [0,0,0,0,0,0|2,0,2]=4 14 B23R1.131 CCCCCCCCc1ccc(cc1)CCNCCCC(=O)N 34a_100000739312_100016989816 [1,0,0,0,0,0|2,0,0]=3 15 B23R1.131 CCCCCCCCc1ccc(cc1)CCNCCCS(=O)C 2230a_200000753449_100016989816 [1,0,0,0,0,0|2,0,0]=3 16 B23R1.131 CCCCCCCCc1ccc(cc1)CCNCCNC(=O)C 2230a_100000209853_100016989816 [1,0,0,0,0,0|3,0,0]=4 17 B23R1.131 CCCCCCCCc1ccc(cc1)CCNCCNC(=O)N 34a_100020590234_100016989816 [1,0,0,0,0,0|3,0,0]=4 18 B23R1.131 CCCCCCCCc1ccc(cc1)CCOCCCC(=O)N 34a_200016989815_100102525003 [1,0,0,0,0,0|3,0,0]=4 19 B23R1.131 CCCCCCCCc1ccc(cc1)CCOCCCC(=O)N 7a_200016989815_100102525003 [1,0,0,0,0,0|3,0,0]=4 20 B23R1.131 CCCCCCCCc1ccc(cc1)CCOCCC[N+](=O)[O-] 34a_200000037920_100016989816 [1,0,0,0,0,0|1,1,1]=4 21 B23R1.131 CCCCCCCCc1ccc(cc1)CNCCCCB(O)O 2230a_200010007124_200009817182 [1,0,0,0,0,0|3,0,0]=4 22 B23R1.131 CCCCCCCCc1ccc(cc1)CNCCCCB(O)O 34a_200010007124_200009817182 [1,0,0,0,0,0|3,0,0]=4 23 B23R1.131 CCCCCCCCc1ccc(cc1)NCCCCCB(O)O 2230a_100000032498_200009817188 [1,0,0,0,0,0|3,0,0]=4 24 B23R1.131 CCCCCCCCc1ccc(cc1)NCCCCCB(O)O 34a_100000032498_200009817188 [1,0,0,0,0,0|3,0,0]=4 25 B23R1.131 CCCCCCCCc1ccc(cc1)NCCCCCB(O)O 7a_100000032498_200009817188 [1,0,0,0,0,0|3,0,0]=4 26 B23R1.131 CCCCCCCCc1ccc(cc1)OCCCCCB(O)O 34a_100000011237_200009817188 [1,0,0,0,0,0|3,0,0]=4 27 B23R1.131 CCCCCCCCc1ccc(cc1)OCCCCCB(O)O 7a_100000011237_200009817188 [1,0,0,0,0,0|3,0,0]=4 28 B25R2.389914 CCCCCCCCc1ccc(cc1)CCN2CCCC(C2)(C)O 2230a_100000695535_100016989816 [0,0,0,1,0,0|3,0,0]=4 29 B25R2.389914 CCCCCCCCc1ccc(cc1)CCN2CCCC(C2)(C)O 269982a_100000695535_100016989816 [0,0,0,1,0,0|3,0,0]=4 30 B25R2.1511324 CCCCCCCCc1ccc(cc1)CCNC2CCS(=O)(=O)C2 2230a_100000683523_100016989816 [0,0,0,1,0,0|2,0,1]=4 31 B25R2.1511324 CCCCCCCCc1ccc(cc1)CCNC2CCS(=O)(=O)C2 34a_100000683523_100016989816 [0,0,0,1,0,0|2,0,1]=4 32 B25R2.29119276 CCCCCCCCc1ccc(cc1)CCNC[C@H]2C[C@@](C2)(C)O 2230a_100015257651_100016989816 [0,0,0,1,0,0|3,0,0]=4 33 B23R1.19699 CCCCCCCCc1ccc(cc1)CCNCCS(=O)(=O)C 2230a_100000740961_100016989816 [0,0,0,0,1,0|2,0,1]=4 34 B23R1.19699 CCCCCCCCc1ccc(cc1)CCNCCS(=O)(=O)C 34a_100000740961_100016989816 [0,0,0,0,1,0|2,0,1]=4 35 B23R1.19699 CCCCCCCCc1ccc(cc1)CCNCCS(=O)(=O)N 2230a_100000738205_100016989816 [0,0,0,0,1,0|2,0,1]=4 36 B23R1.19699 CCCCCCCCc1ccc(cc1)CCNCCS(=O)(=O)N 34a_100000738205_100016989816 [0,0,0,0,1,0|2,0,1]=4 37 B23R1.19699 CCCCCCCCc1ccc(cc1)CNCCCS(=O)(=O)C 2230a_200010007124_100000754308 [0,0,0,0,1,0|2,0,1]=4 38 B23R1.19699 CCCCCCCCc1ccc(cc1)CNCCCS(=O)(=O)C 34a_200010007124_100000754308 [0,0,0,0,1,0|2,0,1]=4 39 B23R1.19699 CCCCCCCCc1ccc(cc1)CNCCCS(=O)(=O)N 2230a_200010007124_100000750626 [0,0,0,0,1,0|2,0,1]=4 40 B23R1.19699 CCCCCCCCc1ccc(cc1)CNCCCS(=O)(=O)N 34a_200010007124_100000750626 [0,0,0,0,1,0|2,0,1]=4 41 B23R1.19699 CCCCCCCCc1ccc(cc1)CNCCCS(=O)(=O)[O-] 34a_200010007124_100009813499 [0,0,0,0,1,0|1,0,2]=4 42 B23R1.19699 CCCCCCCOc1ccc(cc1)CNCCC[Si](O)(O)O 207a_100000066040_100000189358 [0,0,0,0,1,0|2,0,1]=4 43 B22R1.258 CCCCCCCCc1ccc(cc1)CCNCCCCO 2230a_100000750430_100016989816 [2,0,0,0,0,0|1,0,0]=3 44 B22R1.258 CCCCCCCCc1ccc(cc1)CCNCCCCO 34a_100000750430_100016989816 [2,0,0,0,0,0|1,0,0]=3 45 B22R1.258 CCCCCCCCc1ccc(cc1)CCNCCCOC 34a_100150723488_100016989816 [2,0,0,0,0,0|2,0,0]=4 46 B22R1.258 CCCCCCCCc1ccc(cc1)CCOCCCCO 34a_200016989815_100011216708 [2,0,0,0,0,0|2,0,0]=4 47 B22R1.258 CCCCCCCCc1ccc(cc1)CCOCCCCO 7a_200016989815_100000210776 [2,0,0,0,0,0|2,0,0]=4 48 B24R1.18121 CCCCCCCCc1ccc(cc1)CCN(C)CCCC(=O)O 269956a_100000719178_100016989816 [1,1,0,0,0,0|1,0,0]=3 49 B24R1.18219 CCCCCCCCc1ccc(cc1)CCNCC(O)CC(=O)O 269956a_100011218706_100016989816 [1,1,0,0,0,0|1,0,0]=3 50 B24R1.18316 CCCCCCCCc1ccc(cc1)CCNCCCC(=O)NC 2230a_100000740002_100016989816 [1,1,0,0,0,0|2,0,0]=4 51 B24R1.18316 CCCCCCCCc1ccc(cc1)CCNCCCC(=O)NC 34a_100000740002_100016989816 [1,1,0,0,0,0|2,0,0]=4 52 B24R1.16391 CCCCCCCCOc1ccc(cc1)CNCCC[Si](O)(O)O 207a_100000066040_100000261162 [0,1,0,0,1,0|1,0,1]=4 53 B24R2.10665 CCCCCCCCc1ccc(cc1)CCN[C@H]2CC[C@H](C2)O 2230a_100015195300_100016989816 [1,0,0,1,0,0|2,0,0]=4 54 B24R2.10675 CCCCCCCCc1ccc(cc1)CCN2CCCC(C2)O 2230a_100000211013_100016989816 [1,0,0,1,0,0|2,0,0]=4 55 B24R2.10675 CCCCCCCCc1ccc(cc1)CCN2CCCC(C2)O 269982a_100000211013_100016989816 [1,0,0,1,0,0|2,0,0]=4 56 B24R2.1207443 CCCCCCCCc1ccc(cc1)CCN2CCC2C(=O)O 269956a_100000021838_100016989816 [1,0,0,1,0,0|1,0,0]=3 57 B24R2.1207483 CCCCCCCCc1ccc(cc1)CCNCC2CC(C2)O 2230a_100016992100_100016989816 [1,0,0,1,0,0|2,0,0]=4 58 B22R1.260 CCCCCCCCc1ccc(cc1)CCNCCC(C)O 2230a_200000755665_100016989816 [1,0,0,0,1,0|2,0,0]=4 59 B22R1.260 CCCCCCCCc1ccc(cc1)CCNOCC(=O)O 269956a_100000106656_100016989816 [1,0,0,0,1,0|2,0,0]=4 60 B22R1.260 CCCCCCCCc1ccc(cc1)CNCCCC(=O)N 34a_200010007124_100102525003 [1,0,0,0,1,0|2,0,0]=4 61 B22R1.260 CCCCCCCCc1ccc(cc1)CNCCCC(C)O 2230a_200010007124_200000718107 [1,0,0,0,1,0|2,0,0]=4 62 B22R1.260 CCCCCCCCc1ccc(cc1)CNCCCC(C)O 34a_200010007124_200000718107 [1,0,0,0,1,0|2,0,0]=4 63 B22R1.260 CCCCCCCCc1ccc(cc1)NCCCCB(O)O 2230a_100000032498_200009817182 [1,0,0,0,1,0|2,0,0]=4 64 B22R1.260 CCCCCCCCc1ccc(cc1)NCCCCB(O)O 34a_100000032498_200009817182 [1,0,0,0,1,0|2,0,0]=4 65 B22R1.260 CCCCCCCCc1ccc(cc1)NCCCCB(O)O 7a_100000032498_200009817182 [1,0,0,0,1,0|2,0,0]=4 66 B22R1.260 CCCCCCCCc1ccc(cc1)OCCCCB(O)O 34a_100000011237_200009817182 [1,0,0,0,1,0|2,0,0]=4 67 B22R1.260 CCCCCCCCc1ccc(cc1)OCCCCB(O)O 7a_100000011237_200009817182 [1,0,0,0,1,0|2,0,0]=4 68 B22R1.260 CCCCCCCCc1ccc(cc1)SCCCCB(O)O 62a_200009817182_100009813488 [1,0,0,0,1,0|2,0,0]=4 69 B22R1.80840 CCCCCCCc1ccc(cc1)CNCCC[Si](O)(O)O 207a_100000066040_100009998032 [1,0,0,0,1,0|1,0,1]=4 70 B24R1.18220 CCCCCCCCc1ccc(cc1)CCNCCCNC(=O)C 34a_100000736810_100016989816 [1,0,0,0,0,1|2,0,0]=4