Worst predictions : D4H10_fi_e125_s6_lowestPos.txt

rAtomId = 17473, atomId = 10929, opReactId = 2724 rxnConditionsId= 1, smi = C=C[CH:1](c1ccccc1)Br target = 1, prediction = 0.287868309945, rank prediction = 1410 isPredictedFilled = True, isPredictedUnfilled = True

rAtomId = 13003, atomId = 12549, opReactId = 2842 rxnConditionsId= 2, smi = COc1cc[cH:1]c(c1)[N+](=O)[O-] target = 1, prediction = 0.35227806339, rank prediction = 1432 isPredictedFilled = True, isPredictedUnfilled = False

rAtomId = 17474, atomId = 3053, opReactId = 1791 rxnConditionsId= 1, smi = CC(=C)C[OH:1] target = 1, prediction = 0.424681356772, rank prediction = 1450 isPredictedFilled = True, isPredictedUnfilled = False

rAtomId = 9642, atomId = 5890, opReactId = 2141 rxnConditionsId= 3, smi = COc1cc[cH:1]cc1 target = 1, prediction = 0.508511024372, rank prediction = 1466 isPredictedFilled = True, isPredictedUnfilled = False

rAtomId = 11671, atomId = 2348, opReactId = 1750 rxnConditionsId= 1, smi = CC1(CC[CH+]C1([CH3:1])C)C target = 1, prediction = 0.539762306872, rank prediction = 1474 isPredictedFilled = True, isPredictedUnfilled = False

rAtomId = 9579, atomId = 3201, opReactId = 1818 rxnConditionsId= 1, smi = [cH:1]1ccc(cc1)Br target = 1, prediction = 0.552234173074, rank prediction = 1480 isPredictedFilled = True, isPredictedUnfilled = False

rAtomId = 8386, atomId = 5240, opReactId = 2036 rxnConditionsId= 2, smi = CC=C[CH:1](C)[OH2+] target = 1, prediction = 0.583202898414, rank prediction = 1488 isPredictedFilled = True, isPredictedUnfilled = True

rAtomId = 6434, atomId = 4504, opReactId = 1953 rxnConditionsId= 1, smi = CC#[N:1] target = 1, prediction = 0.610051064534, rank prediction = 1494 isPredictedFilled = True, isPredictedUnfilled = False

rAtomId = 12823, atomId = 13587, opReactId = 2968 rxnConditionsId= 2, smi = [CH2:1]=CCCCc1ccccc1 target = 1, prediction = 0.6347269358, rank prediction = 1500 isPredictedFilled = True, isPredictedUnfilled = False

rAtomId = 9177, atomId = 1907, opReactId = 1710 rxnConditionsId= 1, smi = CC=C[N:1](C)C target = 1, prediction = 0.642034357881, rank prediction = 1504 isPredictedFilled = True, isPredictedUnfilled = False

rAtomId = 13067, atomId = 6320, opReactId = 2185 rxnConditionsId= 3, smi = CCOC(=O)CC(C)([NH:1]C)[OH2+] target = 1, prediction = 0.658093585473, rank prediction = 1505 isPredictedFilled = True, isPredictedUnfilled = False

rAtomId = 18699, atomId = 15341, opReactId = 3170 rxnConditionsId= 1, smi = CC[NH+](CC)C(C)(C)[O-:1] target = 1, prediction = 0.689993216624, rank prediction = 1509 isPredictedFilled = True, isPredictedUnfilled = False

rAtomId = 1919, atomId = 3201, opReactId = 1818 rxnConditionsId= 2, smi = [cH:1]1ccc(cc1)Br target = 1, prediction = 0.698315455979, rank prediction = 1512 isPredictedFilled = True, isPredictedUnfilled = False

rAtomId = 11115, atomId = 12777, opReactId = 2920 rxnConditionsId= 2, smi = [CH2:1]=CCOc1ccccc1 target = 1, prediction = 0.70454125023, rank prediction = 1514 isPredictedFilled = True, isPredictedUnfilled = False

rAtomId = 4562, atomId = 8570, opReactId = 2441 rxnConditionsId= 6, smi = c1cnc[c-:1]c1N target = 1, prediction = 0.7148300069, rank prediction = 1515 isPredictedFilled = True, isPredictedUnfilled = False

rAtomId = 10939, atomId = 2545, opReactId = 1663 rxnConditionsId= 1, smi = CC[CH+][CH:1]=CC target = 1, prediction = 0.72246615672, rank prediction = 1516 isPredictedFilled = True, isPredictedUnfilled = False

rAtomId = 3994, atomId = 4504, opReactId = 1953 rxnConditionsId= 2, smi = CC#[N:1] target = 1, prediction = 0.737519203939, rank prediction = 1524 isPredictedFilled = True, isPredictedUnfilled = False

rAtomId = 5933, atomId = 5505, opReactId = 2078 rxnConditionsId= 2, smi = C[CH:1](C=C)[OH2+] target = 1, prediction = 0.743243553951, rank prediction = 1526 isPredictedFilled = True, isPredictedUnfilled = True

rAtomId = 9380, atomId = 9956, opReactId = 2591 rxnConditionsId= 1, smi = CC[C-:1]([N+](=O)[O-])Br target = 1, prediction = 0.743689119305, rank prediction = 1527 isPredictedFilled = True, isPredictedUnfilled = False

rAtomId = 9581, atomId = 3203, opReactId = 1818 rxnConditionsId= 1, smi = c1c[cH:1]c(cc1)Br target = 1, prediction = 0.747262172342, rank prediction = 1530 isPredictedFilled = True, isPredictedUnfilled = False

rAtomId = 11116, atomId = 12784, opReactId = 2920 rxnConditionsId= 2, smi = C=CCOc1cc[cH:1]cc1 target = 1, prediction = 0.774640493952, rank prediction = 1536 isPredictedFilled = True, isPredictedUnfilled = False

rAtomId = 15968, atomId = 12052, opReactId = 2855 rxnConditionsId= 2, smi = c1c[cH:1]c(cc1)CC[C+]=O target = 1, prediction = 0.784476890427, rank prediction = 1540 isPredictedFilled = True, isPredictedUnfilled = False

rAtomId = 8644, atomId = 4996, opReactId = 2002 rxnConditionsId= 1, smi = C(C=O)[O:1]C(CO)[OH2+] target = 1, prediction = 0.792898366329, rank prediction = 1542 isPredictedFilled = True, isPredictedUnfilled = False

rAtomId = 14082, atomId = 6219, opReactId = 2180 rxnConditionsId= 3, smi = CCOC(=O)CC(C)(NC)[OH:1] target = 1, prediction = 0.796123949952, rank prediction = 1543 isPredictedFilled = True, isPredictedUnfilled = False

rAtomId = 2905, atomId = 5023, opReactId = 2014 rxnConditionsId= 2, smi = CC[C:1](C)(C)[OH2+] target = 1, prediction = 0.810786794609, rank prediction = 1547 isPredictedFilled = True, isPredictedUnfilled = True

rAtomId = 14574, atomId = 1026, opReactId = 1513 rxnConditionsId= 1, smi = C[C:1]#CC target = 1, prediction = 0.811468154846, rank prediction = 1548 isPredictedFilled = True, isPredictedUnfilled = False

rAtomId = 1920, atomId = 3203, opReactId = 1818 rxnConditionsId= 2, smi = c1c[cH:1]c(cc1)Br target = 1, prediction = 0.841706347768, rank prediction = 1552 isPredictedFilled = True, isPredictedUnfilled = False

rAtomId = 13428, atomId = 5266, opReactId = 2045 rxnConditionsId= 1, smi = CNC=[CH:1]CO target = 1, prediction = 0.859000142181, rank prediction = 1560 isPredictedFilled = True, isPredictedUnfilled = False

rAtomId = 4983, atomId = 7855, opReactId = 2354 rxnConditionsId= 1, smi = CCC1CCCC([CH:1]1Cl)C target = 1, prediction = 0.863378047537, rank prediction = 1561 isPredictedFilled = True, isPredictedUnfilled = True

rAtomId = 2320, atomId = 10482, opReactId = 2681 rxnConditionsId= 3, smi = C1CCC(CC1)NC(=O)[N-:1]C2CCCCC2 target = 1, prediction = 0.881572935028, rank prediction = 1564 isPredictedFilled = True, isPredictedUnfilled = False