Worst predictions : D4H0_un_e134_s9_lowestPos.txt

rAtomId = 17498, atomId = 5724, opReactId = 2107 rxnConditionsId= 6, smi = [CH2:1](C[O-])CBr target = 1, prediction = 0.100168372199, rank prediction = 985 isPredictedFilled = False, isPredictedUnfilled = True

rAtomId = 17556, atomId = 10186, opReactId = 2641 rxnConditionsId= 3, smi = [CH3:1]C[N+](C)(C)C target = 1, prediction = 0.20379906319, rank prediction = 1229 isPredictedFilled = False, isPredictedUnfilled = True

rAtomId = 14817, atomId = 5724, opReactId = 2107 rxnConditionsId= 7, smi = [CH2:1](C[O-])CBr target = 1, prediction = 0.207902835119, rank prediction = 1233 isPredictedFilled = False, isPredictedUnfilled = True

rAtomId = 4229, atomId = 10752, opReactId = 2704 rxnConditionsId= 3, smi = CCC([CH3:1])[N+](C)(C)C target = 1, prediction = 0.214133090921, rank prediction = 1240 isPredictedFilled = False, isPredictedUnfilled = True

rAtomId = 11350, atomId = 3790, opReactId = 1888 rxnConditionsId= 1, smi = [CH2:1]=CC#[NH+] target = 1, prediction = 0.220183826022, rank prediction = 1244 isPredictedFilled = False, isPredictedUnfilled = True

rAtomId = 8899, atomId = 8334, opReactId = 2362 rxnConditionsId= 6, smi = CC1C=CC[CH2:1]C1Br target = 1, prediction = 0.273779849632, rank prediction = 1302 isPredictedFilled = False, isPredictedUnfilled = True

rAtomId = 4973, atomId = 8565, opReactId = 2440 rxnConditionsId= 6, smi = C1=CN=CC#[C:1]1 target = 1, prediction = 0.32203035558, rank prediction = 1352 isPredictedFilled = False, isPredictedUnfilled = True

rAtomId = 2444, atomId = 11423, opReactId = 2792 rxnConditionsId= 1, smi = c1ccc(cc1)CC(=CC(=O)[OH:1])O target = 1, prediction = 0.393171111243, rank prediction = 1411 isPredictedFilled = False, isPredictedUnfilled = True

rAtomId = 14150, atomId = 7856, opReactId = 2356 rxnConditionsId= 6, smi = CC1(CC[CH2:1]C1Br)Br target = 1, prediction = 0.404875984941, rank prediction = 1424 isPredictedFilled = False, isPredictedUnfilled = True

rAtomId = 15407, atomId = 7445, opReactId = 2305 rxnConditionsId= 3, smi = [CH3:1]C(=O)c1cccc(c1)Br target = 1, prediction = 0.458985781492, rank prediction = 1460 isPredictedFilled = False, isPredictedUnfilled = True

rAtomId = 13017, atomId = 4449, opReactId = 1955 rxnConditionsId= 2, smi = C[C:1]#[NH+] target = 1, prediction = 0.467414944589, rank prediction = 1466 isPredictedFilled = False, isPredictedUnfilled = True

rAtomId = 11372, atomId = 8334, opReactId = 2362 rxnConditionsId= 7, smi = CC1C=CC[CH2:1]C1Br target = 1, prediction = 0.470587259255, rank prediction = 1469 isPredictedFilled = False, isPredictedUnfilled = True

rAtomId = 14152, atomId = 7852, opReactId = 2356 rxnConditionsId= 6, smi = CC1([CH2:1]CCC1Br)Br target = 1, prediction = 0.476636940268, rank prediction = 1475 isPredictedFilled = False, isPredictedUnfilled = True

rAtomId = 9372, atomId = 7105, opReactId = 2267 rxnConditionsId= 3, smi = C[C:1](=O)CCC(=O)c1ccccc1 target = 1, prediction = 0.51346951692, rank prediction = 1491 isPredictedFilled = False, isPredictedUnfilled = True

rAtomId = 12986, atomId = 6208, opReactId = 2179 rxnConditionsId= 1, smi = CN(C)C(=O)C=C(Cc1ccccc1)[OH:1] target = 1, prediction = 0.520831622781, rank prediction = 1501 isPredictedFilled = False, isPredictedUnfilled = True

rAtomId = 8012, atomId = 1969, opReactId = 1523 rxnConditionsId= 2, smi = C[CH:1]=[N+](C)C target = 1, prediction = 0.5280040712, rank prediction = 1503 isPredictedFilled = False, isPredictedUnfilled = True

rAtomId = 16480, atomId = 14105, opReactId = 3053 rxnConditionsId= 1, smi = CCO[CH:1]=O target = 1, prediction = 0.528827913175, rank prediction = 1505 isPredictedFilled = False, isPredictedUnfilled = True

rAtomId = 14232, atomId = 5611, opReactId = 2097 rxnConditionsId= 1, smi = COC(=O)C=C(Cc1ccccc1)[OH:1] target = 1, prediction = 0.538672501673, rank prediction = 1513 isPredictedFilled = False, isPredictedUnfilled = True

rAtomId = 11474, atomId = 5884, opReactId = 2140 rxnConditionsId= 1, smi = CNC(=O)C=C(Cc1ccccc1)[OH:1] target = 1, prediction = 0.5427116141, rank prediction = 1515 isPredictedFilled = False, isPredictedUnfilled = True

rAtomId = 14660, atomId = 3268, opReactId = 1824 rxnConditionsId= 1, smi = CCO[C:1](=O)CCC(=O)NC target = 1, prediction = 0.545163216656, rank prediction = 1517 isPredictedFilled = False, isPredictedUnfilled = True

rAtomId = 13358, atomId = 6516, opReactId = 2216 rxnConditionsId= 1, smi = CCO[C:1](=O)CCC(=C)[O-] target = 1, prediction = 0.568720630416, rank prediction = 1529 isPredictedFilled = False, isPredictedUnfilled = True

rAtomId = 15451, atomId = 14124, opReactId = 3055 rxnConditionsId= 1, smi = CCO[CH:1](C1CCCCC1=O)[O-] target = 1, prediction = 0.573450685542, rank prediction = 1532 isPredictedFilled = False, isPredictedUnfilled = True

rAtomId = 5545, atomId = 4449, opReactId = 1955 rxnConditionsId= 1, smi = C[C:1]#[NH+] target = 1, prediction = 0.582084368267, rank prediction = 1538 isPredictedFilled = False, isPredictedUnfilled = True

rAtomId = 4483, atomId = 6342, opReactId = 2187 rxnConditionsId= 3, smi = CCOC(=O)CC(=[NH+:1]C)C target = 1, prediction = 0.595793745584, rank prediction = 1545 isPredictedFilled = False, isPredictedUnfilled = True

rAtomId = 6849, atomId = 3913, opReactId = 1917 rxnConditionsId= 1, smi = CC[C:1](=O)C target = 1, prediction = 0.596194899859, rank prediction = 1546 isPredictedFilled = False, isPredictedUnfilled = True

rAtomId = 18173, atomId = 6208, opReactId = 2179 rxnConditionsId= 3, smi = CN(C)C(=O)C=C(Cc1ccccc1)[OH:1] target = 1, prediction = 0.601665537307, rank prediction = 1547 isPredictedFilled = False, isPredictedUnfilled = True

rAtomId = 4976, atomId = 8564, opReactId = 2440 rxnConditionsId= 6, smi = C1=CN=C[C:1]#C1 target = 1, prediction = 0.6032025355, rank prediction = 1549 isPredictedFilled = False, isPredictedUnfilled = True

rAtomId = 16566, atomId = 7856, opReactId = 2356 rxnConditionsId= 7, smi = CC1(CC[CH2:1]C1Br)Br target = 1, prediction = 0.615987823759, rank prediction = 1553 isPredictedFilled = False, isPredictedUnfilled = True

rAtomId = 6328, atomId = 1601, opReactId = 1691 rxnConditionsId= 1, smi = CC(=O)[OH:1] target = 1, prediction = 0.616982529713, rank prediction = 1555 isPredictedFilled = False, isPredictedUnfilled = True

rAtomId = 9165, atomId = 5611, opReactId = 2097 rxnConditionsId= 3, smi = COC(=O)C=C(Cc1ccccc1)[OH:1] target = 1, prediction = 0.61870011489, rank prediction = 1556 isPredictedFilled = False, isPredictedUnfilled = True