Worst predictions : D4H0_fi_e129_s5_lowestPos.txt

rAtomId = 16817, atomId = 4721, opReactId = 1981 rxnConditionsId= 1, smi = C[CH+][CH:1](C)C=O target = 1, prediction = 0.49994159013, rank prediction = 1425 isPredictedFilled = True, isPredictedUnfilled = False

rAtomId = 1783, atomId = 5985, opReactId = 2156 rxnConditionsId= 1, smi = CC[CH:1](C)Br target = 1, prediction = 0.55336539355, rank prediction = 1454 isPredictedFilled = True, isPredictedUnfilled = True

rAtomId = 18040, atomId = 1830, opReactId = 1506 rxnConditionsId= 1, smi = CC(C)c1cc[cH:1]cc1 target = 1, prediction = 0.610946389976, rank prediction = 1478 isPredictedFilled = True, isPredictedUnfilled = False

rAtomId = 16642, atomId = 3935, opReactId = 1901 rxnConditionsId= 1, smi = c1ccc2c(c1)[cH:1]ccc2Br target = 1, prediction = 0.61665021092, rank prediction = 1484 isPredictedFilled = True, isPredictedUnfilled = False

rAtomId = 6623, atomId = 12222, opReactId = 2853 rxnConditionsId= 2, smi = c1c[cH:1]c(cc1)CCC[C+]=O target = 1, prediction = 0.642191677867, rank prediction = 1491 isPredictedFilled = True, isPredictedUnfilled = False

rAtomId = 1383, atomId = 8640, opReactId = 2448 rxnConditionsId= 3, smi = [Li][CH2:1]C=CC target = 1, prediction = 0.644676589148, rank prediction = 1492 isPredictedFilled = True, isPredictedUnfilled = False

rAtomId = 11433, atomId = 5930, opReactId = 2146 rxnConditionsId= 3, smi = [Li][c:1]1ccccc1 target = 1, prediction = 0.679131545097, rank prediction = 1504 isPredictedFilled = True, isPredictedUnfilled = False

rAtomId = 16892, atomId = 1830, opReactId = 1506 rxnConditionsId= 2, smi = CC(C)c1cc[cH:1]cc1 target = 1, prediction = 0.686325583022, rank prediction = 1509 isPredictedFilled = True, isPredictedUnfilled = False

rAtomId = 14202, atomId = 3935, opReactId = 1901 rxnConditionsId= 2, smi = c1ccc2c(c1)[cH:1]ccc2Br target = 1, prediction = 0.691482352887, rank prediction = 1512 isPredictedFilled = True, isPredictedUnfilled = False

rAtomId = 14351, atomId = 10787, opReactId = 2714 rxnConditionsId= 1, smi = CC(C)[CH:1](CC=C(C)C)Cl target = 1, prediction = 0.69328529838, rank prediction = 1514 isPredictedFilled = True, isPredictedUnfilled = True

rAtomId = 9032, atomId = 4332, opReactId = 1935 rxnConditionsId= 1, smi = CCNC(C=C)([OH:1])OC(=O)C target = 1, prediction = 0.722429683318, rank prediction = 1519 isPredictedFilled = True, isPredictedUnfilled = False

rAtomId = 4317, atomId = 3172, opReactId = 1695 rxnConditionsId= 1, smi = CC(=O)C[C:1](C)(C)[OH2+] target = 1, prediction = 0.741171195682, rank prediction = 1525 isPredictedFilled = True, isPredictedUnfilled = True

rAtomId = 13047, atomId = 1911, opReactId = 1517 rxnConditionsId= 1, smi = C1[CH:1]=CCC=C1 target = 1, prediction = 0.758163648706, rank prediction = 1530 isPredictedFilled = True, isPredictedUnfilled = False

rAtomId = 7263, atomId = 1843, opReactId = 1581 rxnConditionsId= 1, smi = C[C:1]1(CCC(=O)C1)[OH2+] target = 1, prediction = 0.766684756863, rank prediction = 1532 isPredictedFilled = True, isPredictedUnfilled = True

rAtomId = 11414, atomId = 12318, opReactId = 2874 rxnConditionsId= 2, smi = c1ccc2c([cH:1]1)cccc2C#N target = 1, prediction = 0.774999511024, rank prediction = 1536 isPredictedFilled = True, isPredictedUnfilled = False

rAtomId = 10879, atomId = 2893, opReactId = 1780 rxnConditionsId= 1, smi = CCOC(C=C)([OH:1])Cl target = 1, prediction = 0.806820699674, rank prediction = 1545 isPredictedFilled = True, isPredictedUnfilled = False

rAtomId = 6545, atomId = 11611, opReactId = 2813 rxnConditionsId= 3, smi = CC=N[OH:1] target = 1, prediction = 0.820562345441, rank prediction = 1549 isPredictedFilled = True, isPredictedUnfilled = False

rAtomId = 17455, atomId = 8979, opReactId = 2480 rxnConditionsId= 3, smi = CC[N:1](CC)C(C)(C#CC)[OH2+] target = 1, prediction = 0.82059120864, rank prediction = 1550 isPredictedFilled = True, isPredictedUnfilled = False

rAtomId = 17036, atomId = 15220, opReactId = 3159 rxnConditionsId= 3, smi = C1CCC(=[CH:1]C1)O target = 1, prediction = 0.825384371234, rank prediction = 1551 isPredictedFilled = True, isPredictedUnfilled = False

rAtomId = 17199, atomId = 3637, opReactId = 1784 rxnConditionsId= 1, smi = C=CC([OH:1])(O)Cl target = 1, prediction = 0.839773484084, rank prediction = 1555 isPredictedFilled = True, isPredictedUnfilled = False

rAtomId = 13212, atomId = 4707, opReactId = 1980 rxnConditionsId= 1, smi = CC(C=O)[CH:1](C)[OH2+] target = 1, prediction = 0.842741812699, rank prediction = 1556 isPredictedFilled = True, isPredictedUnfilled = True

rAtomId = 4199, atomId = 13808, opReactId = 3029 rxnConditionsId= 1, smi = C=CC(=O)NCCC(=[NH:1])[O-] target = 1, prediction = 0.846219029513, rank prediction = 1557 isPredictedFilled = True, isPredictedUnfilled = False

rAtomId = 3040, atomId = 4866, opReactId = 1841 rxnConditionsId= 3, smi = CC[NH:1]C(C)(C)[OH2+] target = 1, prediction = 0.849977189974, rank prediction = 1559 isPredictedFilled = True, isPredictedUnfilled = False

rAtomId = 2905, atomId = 5023, opReactId = 2014 rxnConditionsId= 2, smi = CC[C:1](C)(C)[OH2+] target = 1, prediction = 0.857438307085, rank prediction = 1563 isPredictedFilled = True, isPredictedUnfilled = True

rAtomId = 16982, atomId = 3569, opReactId = 1864 rxnConditionsId= 1, smi = C1CCC(CC1)([N:1]2CCCCC2)[OH2+] target = 1, prediction = 0.860272386133, rank prediction = 1565 isPredictedFilled = True, isPredictedUnfilled = False

rAtomId = 7814, atomId = 9167, opReactId = 2509 rxnConditionsId= 1, smi = CC[NH2+]C(C)(C)[O-:1] target = 1, prediction = 0.861256609918, rank prediction = 1567 isPredictedFilled = True, isPredictedUnfilled = False

rAtomId = 5292, atomId = 5129, opReactId = 2029 rxnConditionsId= 1, smi = CC[O:1]C(CC(=O)C)(O)O target = 1, prediction = 0.870101911448, rank prediction = 1568 isPredictedFilled = True, isPredictedUnfilled = False

rAtomId = 9650, atomId = 3725, opReactId = 1883 rxnConditionsId= 1, smi = CC1C([OH+]1)CCC[OH:1] target = 1, prediction = 0.871236608705, rank prediction = 1569 isPredictedFilled = True, isPredictedUnfilled = False

rAtomId = 13564, atomId = 1606, opReactId = 1487 rxnConditionsId= 1, smi = CC1C[O:1]1 target = 1, prediction = 0.882422915985, rank prediction = 1571 isPredictedFilled = True, isPredictedUnfilled = False

rAtomId = 16700, atomId = 12032, opReactId = 2837 rxnConditionsId= 2, smi = COc1c(c[cH:1]cc1Br)Br target = 1, prediction = 0.884385846051, rank prediction = 1572 isPredictedFilled = True, isPredictedUnfilled = False