-ISIS-  08091621332D

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  8 12  2  0  0  0  0
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M  END
>  <ID> (BBL000857)
BBL000857

>  <Rotatable_Bonds> (BBL000857)
2

>  <logP> (BBL000857)
0.979

>  <PSA> (BBL000857)
64.09

>  <H_Donors> (BBL000857)
1

>  <H_Acceptors> (BBL000857)
3

>  <Number_of_rings> (BBL000857)
3

>  <NAME> (BBL000857)
6-fluoro-1-methyl-7-(4-methylpiperazin-1-yl)-4-oxo-1,4-dihydroquinoline-3-carboxylic acid

>  <Mol_Weight> (BBL000857)
319.34

>  <Mol_Formula> (BBL000857)
C16H18FN3O3

>  <Smiles> (BBL000857)
CN1CCN(CC1)c1cc2n(C)cc(c(=O)c2cc1F)C(=O)O

>  <Alternative_identifier> (BBL000857)
MFCD14729052

$$$$