Worst predictions : D4H0_fi_e126_s3_lowestPos.txt

rAtomId = 9776, atomId = 10303, opReactId = 2669 rxnConditionsId= 3, smi = C(CCN)CC(=O)[OH:1] target = 1, prediction = 0.333585329489, rank prediction = 1360 isPredictedFilled = True, isPredictedUnfilled = False

rAtomId = 13566, atomId = 11045, opReactId = 2744 rxnConditionsId= 1, smi = C[CH:1](CO)Br target = 1, prediction = 0.418691122808, rank prediction = 1405 isPredictedFilled = True, isPredictedUnfilled = True

rAtomId = 17579, atomId = 4706, opReactId = 1979 rxnConditionsId= 1, smi = C[CH+]CCc1[cH:1]cccc1 target = 1, prediction = 0.577909711882, rank prediction = 1490 isPredictedFilled = True, isPredictedUnfilled = False

rAtomId = 2990, atomId = 2957, opReactId = 1727 rxnConditionsId= 1, smi = CC(C)(C)c1cc[cH:1]cc1 target = 1, prediction = 0.585026123156, rank prediction = 1498 isPredictedFilled = True, isPredictedUnfilled = False

rAtomId = 7477, atomId = 4706, opReactId = 1979 rxnConditionsId= 2, smi = C[CH+]CCc1[cH:1]cccc1 target = 1, prediction = 0.659391740303, rank prediction = 1519 isPredictedFilled = True, isPredictedUnfilled = False

rAtomId = 15362, atomId = 10336, opReactId = 2654 rxnConditionsId= 3, smi = C[NH:1]c1ccccc1 target = 1, prediction = 0.663504980297, rank prediction = 1521 isPredictedFilled = True, isPredictedUnfilled = False

rAtomId = 10536, atomId = 2957, opReactId = 1727 rxnConditionsId= 2, smi = CC(C)(C)c1cc[cH:1]cc1 target = 1, prediction = 0.665928510304, rank prediction = 1523 isPredictedFilled = True, isPredictedUnfilled = False

rAtomId = 18488, atomId = 5916, opReactId = 2145 rxnConditionsId= 2, smi = C[CH:1](COC)[OH2+] target = 1, prediction = 0.666757442531, rank prediction = 1524 isPredictedFilled = True, isPredictedUnfilled = True

rAtomId = 5933, atomId = 5505, opReactId = 2078 rxnConditionsId= 2, smi = C[CH:1](C=C)[OH2+] target = 1, prediction = 0.688913317335, rank prediction = 1531 isPredictedFilled = True, isPredictedUnfilled = True

rAtomId = 9177, atomId = 1907, opReactId = 1710 rxnConditionsId= 1, smi = CC=C[N:1](C)C target = 1, prediction = 0.698047614004, rank prediction = 1533 isPredictedFilled = True, isPredictedUnfilled = False

rAtomId = 12830, atomId = 1369, opReactId = 1674 rxnConditionsId= 1, smi = CN(C)c1cc[cH:1]cc1Br target = 1, prediction = 0.71932624974, rank prediction = 1540 isPredictedFilled = True, isPredictedUnfilled = False

rAtomId = 14887, atomId = 3351, opReactId = 1831 rxnConditionsId= 1, smi = CC(C)[O:1]C(C)(C)Br target = 1, prediction = 0.727028238761, rank prediction = 1545 isPredictedFilled = True, isPredictedUnfilled = False

rAtomId = 8805, atomId = 5007, opReactId = 2033 rxnConditionsId= 2, smi = C[CH:1](CC(C)O)[OH2+] target = 1, prediction = 0.729382685415, rank prediction = 1546 isPredictedFilled = True, isPredictedUnfilled = True

rAtomId = 7054, atomId = 12394, opReactId = 2881 rxnConditionsId= 2, smi = c1ccc2c([cH:1]1)cccc2[N+](=O)[O-] target = 1, prediction = 0.737763425235, rank prediction = 1548 isPredictedFilled = True, isPredictedUnfilled = False

rAtomId = 14825, atomId = 4453, opReactId = 1948 rxnConditionsId= 1, smi = c1c[cH:1]c2ccccc2c1 target = 1, prediction = 0.739943884628, rank prediction = 1551 isPredictedFilled = True, isPredictedUnfilled = False

rAtomId = 2944, atomId = 1565, opReactId = 1498 rxnConditionsId= 1, smi = CC(=[CH:1]CCC=C(C)C)C target = 1, prediction = 0.749345002655, rank prediction = 1553 isPredictedFilled = True, isPredictedUnfilled = False

rAtomId = 3824, atomId = 5870, opReactId = 2130 rxnConditionsId= 3, smi = CC(=O)CC([NH:1]C)[OH2+] target = 1, prediction = 0.751449482728, rank prediction = 1555 isPredictedFilled = True, isPredictedUnfilled = False

rAtomId = 8243, atomId = 12213, opReactId = 2852 rxnConditionsId= 2, smi = c1ccc(c([cH:1]1)CC[C+]=O)Br target = 1, prediction = 0.75977973044, rank prediction = 1557 isPredictedFilled = True, isPredictedUnfilled = False

rAtomId = 10552, atomId = 12375, opReactId = 2895 rxnConditionsId= 1, smi = CC(C)([NH:1]O)[OH2+] target = 1, prediction = 0.765006967202, rank prediction = 1558 isPredictedFilled = True, isPredictedUnfilled = False

rAtomId = 13482, atomId = 5593, opReactId = 2099 rxnConditionsId= 6, smi = [CH:1]1=C[N-]C=CC1(N)Cl target = 1, prediction = 0.787141236582, rank prediction = 1565 isPredictedFilled = True, isPredictedUnfilled = False

rAtomId = 7649, atomId = 4319, opReactId = 1880 rxnConditionsId= 1, smi = C[O:1]C(Cc1ccccc1)O target = 1, prediction = 0.793333773779, rank prediction = 1570 isPredictedFilled = True, isPredictedUnfilled = False

rAtomId = 4064, atomId = 6637, opReactId = 2245 rxnConditionsId= 3, smi = CC(=C)[N:1]1CCCC1 target = 1, prediction = 0.800178475247, rank prediction = 1572 isPredictedFilled = True, isPredictedUnfilled = False

rAtomId = 17454, atomId = 4453, opReactId = 1948 rxnConditionsId= 2, smi = c1c[cH:1]c2ccccc2c1 target = 1, prediction = 0.800921432504, rank prediction = 1573 isPredictedFilled = True, isPredictedUnfilled = False

rAtomId = 15994, atomId = 3101, opReactId = 1684 rxnConditionsId= 1, smi = CCNC(C=C)([OH:1])Cl target = 1, prediction = 0.807405143108, rank prediction = 1575 isPredictedFilled = True, isPredictedUnfilled = False

rAtomId = 12612, atomId = 1504, opReactId = 1473 rxnConditionsId= 1, smi = C[CH:1](CC=O)[OH2+] target = 1, prediction = 0.812878295336, rank prediction = 1577 isPredictedFilled = True, isPredictedUnfilled = True

rAtomId = 11091, atomId = 2712, opReactId = 1771 rxnConditionsId= 1, smi = C1CC[O:1]C(C1)O target = 1, prediction = 0.843598759319, rank prediction = 1579 isPredictedFilled = True, isPredictedUnfilled = False

rAtomId = 4714, atomId = 3168, opReactId = 1803 rxnConditionsId= 1, smi = CC(C)C(O)[O:1]C target = 1, prediction = 0.848892108763, rank prediction = 1580 isPredictedFilled = True, isPredictedUnfilled = False

rAtomId = 9176, atomId = 1905, opReactId = 1710 rxnConditionsId= 1, smi = C[CH:1]=CN(C)C target = 1, prediction = 0.850560343975, rank prediction = 1581 isPredictedFilled = True, isPredictedUnfilled = False

rAtomId = 4326, atomId = 8441, opReactId = 2415 rxnConditionsId= 3, smi = C[N-]C=[CH:1]CC#N target = 1, prediction = 0.850762193947, rank prediction = 1582 isPredictedFilled = True, isPredictedUnfilled = False

rAtomId = 13569, atomId = 11049, opReactId = 2744 rxnConditionsId= 1, smi = CC(C[OH:1])Br target = 1, prediction = 0.853499147987, rank prediction = 1585 isPredictedFilled = True, isPredictedUnfilled = False