0 B37R3.7452540 CC(C)N(CCCCOCC(=O)CS(=O)(=O)N)c1cnc(c(n1)c2ccccc2)c3ccccc3 1458a_100025777035_100000741382 [0,0,0,0,0,0|2,0,0]=2 1 B37R3.7452540 CC(C)N(CCCCOCC(=O)CS(=O)(=O)[O-])c1cnc(c(n1)c2ccccc2)c3ccccc3 1458a_100025777035_100009817235 [0,0,0,0,0,0|2,0,0]=2 2 B37R3.7452540 CC(C)N(CCCCOCC(=O)NS(=O)(=O)C)c1cnc(c(n1)c2ccccc2)c3ccccc3 2740a_100000171171_100025777035 [0,0,0,0,0,0|0,0,0]=0 3 B37R3.7452540 CC(C)N(CCCCOCC(=O)NS(=O)(=O)C)c1cnc(c(n1)c2ccccc2)c3ccccc3 7a_100102421422_100009907230 [0,0,0,0,0,0|0,0,0]=0 4 B37R3.7452540 CC(C)N(CCCCOCC(O)CS(=O)(=O)[O-])c1cnc(c(n1)c2ccccc2)c3ccccc3 7a_100102421422_100016993520 [0,0,0,0,0,0|2,0,2]=4 5 B36R3.54437474 CC(C)N(CCCCOCCCS(=O)(=O)N)c1cnc(c(n1)c2ccccc2)c3ccccc3 7a_100102421422_100000750626 [1,0,0,0,0,0|2,0,1]=4 6 B36R3.54437474 CC(C)N(CCCCOCCNS(=O)(=O)C)c1cnc(c(n1)c2ccccc2)c3ccccc3 7a_100102421422_100000754112 [1,0,0,0,0,0|0,0,1]=2 7 B36R3.54437474 CC(C)N(CCCCOCCOS(=O)(=O)C)c1cnc(c(n1)c2ccccc2)c3ccccc3 7a_100102421422_200000036756 [1,0,0,0,0,0|1,0,1]=3 8 B36R3.140257303 CC(=O)NC(=O)COCCCCN(c1cnc(c(n1)c2ccccc2)c3ccccc3)C(C)C 7a_100102421422_100000183797 [1,0,0,0,0,0|1,0,0]=2 9 B36R3.140257303 CC(C)N(CCCCOCC(=O)CC(=O)N)c1cnc(c(n1)c2ccccc2)c3ccccc3 1458a_100025777035_100000187820 [1,0,0,0,0,0|3,0,0]=4 10 B36R3.140257303 CC(C)N(CCCCOCC(=O)CC(=O)[O-])c1cnc(c(n1)c2ccccc2)c3ccccc3 1458a_100025777035_100020667443 [1,0,0,0,0,0|2,0,1]=4 11 B36R3.140257303 CC(C)N(CCCCOCC(=O)C[N+](=O)[O-])c1cnc(c(n1)c2ccccc2)c3ccccc3 1458a_100025777035_100000761209 [1,0,0,0,0,0|2,0,1]=4 12 B36R3.140257303 CC(C)N(CCCCOCC(=O)NC(=O)N)c1cnc(c(n1)c2ccccc2)c3ccccc3 7a_100102421422_100000182717 [1,0,0,0,0,0|2,0,0]=3 13 B38R3.33050815 CC(C)N(CCCCOCC(=O)NC(C)(C)CO)c1cnc(c(n1)c2ccccc2)c3ccccc3 240690a_100000210608_100025777035 [0,1,0,0,0,0|2,0,1]=4 14 B38R3.33050815 CC(C)N(CCCCOCC(=O)NC(C)(C)CO)c1cnc(c(n1)c2ccccc2)c3ccccc3 527a_100020618417_100025777035 [0,1,0,0,0,0|2,0,1]=4 15 B38R3.337885062 CC(C)N(CCCCOCC(=O)NCC(C)(C)O)c1cnc(c(n1)c2ccccc2)c3ccccc3 1626a_100000751335_100025777035 [0,0,0,0,0,1|2,0,1]=4 16 B38R3.337885062 CC(C)N(CCCCOCC(=O)NCC(C)(C)O)c1cnc(c(n1)c2ccccc2)c3ccccc3 240690a_100000751335_100025777035 [0,0,0,0,0,1|2,0,1]=4 17 B38R3.337885062 CC(C)N(CCCCOCC(=O)NCC(C)(C)O)c1cnc(c(n1)c2ccccc2)c3ccccc3 527a_100000751335_100025777035 [0,0,0,0,0,1|2,0,1]=4 18 B35R3.67988729 CC(=O)NCCOCCCCN(c1cnc(c(n1)c2ccccc2)c3ccccc3)C(C)C 7a_100102421422_100000189650 [2,0,0,0,0,0|1,0,1]=4 19 B35R3.554839 CC(C)N(CCCCOCC(=O)NCO)c1cnc(c(n1)c2ccccc2)c3ccccc3 7a_100102421422_100000185155 [2,0,0,0,0,0|1,0,1]=4 20 B35R3.554839 CCNC(=O)COCCCCN(c1cnc(c(n1)c2ccccc2)c3ccccc3)C(C)C 11a_100015525214_100025777035 [2,0,0,0,0,0|1,0,0]=3 21 B35R3.554839 CCNC(=O)COCCCCN(c1cnc(c(n1)c2ccccc2)c3ccccc3)C(C)C 240690a_100015525214_100025777035 [2,0,0,0,0,0|1,0,0]=3 22 B35R3.554839 CCNC(=O)COCCCCN(c1cnc(c(n1)c2ccccc2)c3ccccc3)C(C)C 527a_100015525214_100025777035 [2,0,0,0,0,0|1,0,0]=3 23 B35R3.554839 CCNC(=O)COCCCCN(c1cnc(c(n1)c2ccccc2)c3ccccc3)C(C)C 7a_100102421422_100000183381 [2,0,0,0,0,0|1,0,0]=3 24 B35R3.554839 CNNC(=O)COCCCCN(c1cnc(c(n1)c2ccccc2)c3ccccc3)C(C)C 22a_100016993582_100025777035 [2,0,0,0,0,0|1,0,0]=3 25 B37R3.57460551 CC(OCCCCN(c1cnc(c(n1)c2ccccc2)c3ccccc3)C(C)C)C(=O)NC(=O)N 7a_100102421422_100000183865 [1,1,0,0,0,0|2,0,0]=4 26 B37R3.97457346 C#CC(C)NC(=O)COCCCCN(c1cnc(c(n1)c2ccccc2)c3ccccc3)C(C)C 11a_100000707721_100025777035 [1,1,0,0,0,0|2,0,0]=4 27 B37R3.97457346 C#CC(C)NC(=O)COCCCCN(c1cnc(c(n1)c2ccccc2)c3ccccc3)C(C)C 1626a_100000707721_100025777035 [1,1,0,0,0,0|2,0,0]=4 28 B37R3.97457346 C#CC(C)NC(=O)COCCCCN(c1cnc(c(n1)c2ccccc2)c3ccccc3)C(C)C 240690a_100000707721_100025777035 [1,1,0,0,0,0|2,0,0]=4 29 B37R3.97457346 C#CC(C)NC(=O)COCCCCN(c1cnc(c(n1)c2ccccc2)c3ccccc3)C(C)C 527a_100000707721_100025777035 [1,1,0,0,0,0|2,0,0]=4 30 B37R3.97457346 CC(C#N)NC(=O)COCCCCN(c1cnc(c(n1)c2ccccc2)c3ccccc3)C(C)C 11a_100000737613_100025777035 [1,1,0,0,0,0|2,0,0]=4 31 B37R3.97457346 CC(C#N)NC(=O)COCCCCN(c1cnc(c(n1)c2ccccc2)c3ccccc3)C(C)C 1626a_100000737613_100025777035 [1,1,0,0,0,0|2,0,0]=4 32 B37R3.97457346 CC(C#N)NC(=O)COCCCCN(c1cnc(c(n1)c2ccccc2)c3ccccc3)C(C)C 527a_100000737613_100025777035 [1,1,0,0,0,0|2,0,0]=4 33 B37R3.97457346 CC(C)N(CCCCOCC(=O)N[C@H](C)CO)c1cnc(c(n1)c2ccccc2)c3ccccc3 240690a_100000737577_100025777035 [1,1,0,0,0,0|1,0,1]=4 34 B37R3.97457346 CC(C)N(CCCCOCC(=O)N[C@H](C)CO)c1cnc(c(n1)c2ccccc2)c3ccccc3 527a_100000737577_100025777035 [1,1,0,0,0,0|1,0,1]=4 35 B37R3.97457346 CNC(=O)CC(=O)COCCCCN(c1cnc(c(n1)c2ccccc2)c3ccccc3)C(C)C 1458a_100025777035_100000183359 [1,1,0,0,0,0|2,0,0]=4 36 B37R3.97457346 COC(=O)CC(=O)COCCCCN(c1cnc(c(n1)c2ccccc2)c3ccccc3)C(C)C 1458a_100025777035_100000747449 [1,1,0,0,0,0|2,0,0]=4 37 B35R3.70229707 CC(C)N(CCCCOCCS(=O)(=O)C)c1cnc(c(n1)c2ccccc2)c3ccccc3 7a_100102421422_100000230027 [1,0,0,0,1,0|0,0,1]=3 38 B35R3.12026281 CC(C)N(CCCCOCC(=O)N(C)C)c1cnc(c(n1)c2ccccc2)c3ccccc3 11a_100102631434_100025777035 [1,0,0,0,1,0|2,0,0]=4 39 B35R3.12026281 CC(C)N(CCCCOCC(=O)N(C)C)c1cnc(c(n1)c2ccccc2)c3ccccc3 1626a_100102631434_100025777035 [1,0,0,0,1,0|2,0,0]=4 40 B35R3.12026281 CC(C)N(CCCCOCC(=O)N(C)C)c1cnc(c(n1)c2ccccc2)c3ccccc3 240690a_100102631434_100025777035 [1,0,0,0,1,0|2,0,0]=4 41 B35R3.12026281 CC(C)N(CCCCOCC(=O)N(C)C)c1cnc(c(n1)c2ccccc2)c3ccccc3 527a_100102631434_100025777035 [1,0,0,0,1,0|2,0,0]=4 42 B35R3.12026281 CC(C)N(CCCCOCC(=O)N(C)C)c1cnc(c(n1)c2ccccc2)c3ccccc3 7a_100102421422_100000692301 [1,0,0,0,1,0|2,0,0]=4 43 B37R3.57774490 CC(=O)NNC(=O)COCCCCN(c1cnc(c(n1)c2ccccc2)c3ccccc3)C(C)C 22a_100000189765_100025777035 [1,0,0,0,0,1|1,0,0]=3 44 B37R3.57774490 CC(=O)NNC(=O)COCCCCN(c1cnc(c(n1)c2ccccc2)c3ccccc3)C(C)C 7a_100102421422_100000181415 [1,0,0,0,0,1|1,0,0]=3 45 B37R3.57774490 CC(C)N(CCCCOCC(=O)NCC(=O)N)c1cnc(c(n1)c2ccccc2)c3ccccc3 11a_100000711301_100025777035 [1,0,0,0,0,1|2,0,0]=4 46 B37R3.57774490 CC(C)N(CCCCOCC(=O)NCC(=O)N)c1cnc(c(n1)c2ccccc2)c3ccccc3 240690a_100000711301_100025777035 [1,0,0,0,0,1|2,0,0]=4 47 B37R3.57774490 CC(C)N(CCCCOCC(=O)NCC(=O)N)c1cnc(c(n1)c2ccccc2)c3ccccc3 527a_100000711301_100025777035 [1,0,0,0,0,1|2,0,0]=4 48 B37R3.57774490 CC(C)NNC(=O)COCCCCN(c1cnc(c(n1)c2ccccc2)c3ccccc3)C(C)C 22a_100000741168_100025777035 [1,0,0,0,0,1|2,0,0]=4 49 B37R3.57774490 CC(O)CNC(=O)COCCCCN(c1cnc(c(n1)c2ccccc2)c3ccccc3)C(C)C 11a_100000210904_100025777035 [1,0,0,0,0,1|1,0,1]=4 50 B37R3.57774490 CC(O)CNC(=O)COCCCCN(c1cnc(c(n1)c2ccccc2)c3ccccc3)C(C)C 240690a_100000210904_100025777035 [1,0,0,0,0,1|1,0,1]=4 51 B37R3.57774490 CC(O)CNC(=O)COCCCCN(c1cnc(c(n1)c2ccccc2)c3ccccc3)C(C)C 527a_100000210904_100025777035 [1,0,0,0,0,1|1,0,1]=4 52 B37R3.105744276 CC(C)N(CCCCOCCC(=O)NC(=O)N)c1cnc(c(n1)c2ccccc2)c3ccccc3 7a_100102421422_100000237605 [1,0,0,0,0,1|2,0,0]=4