-ISIS-  08091621332D

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  4  3  2  0  0  0  0
 10 20  1  0  0  0  0
M  END
>  <ID> (BBL000812)
BBL000812

>  <Rotatable_Bonds> (BBL000812)
6

>  <logP> (BBL000812)
2.328

>  <PSA> (BBL000812)
113.51

>  <H_Donors> (BBL000812)
0

>  <H_Acceptors> (BBL000812)
5

>  <Number_of_rings> (BBL000812)
3

>  <NAME> (BBL000812)
diethyl 3-methyl-4-oxo-6,7,8,9-tetrahydro-4H-pyrido[1,2-a]thieno[2,3-d]pyrimidine-2,9-dicarboxylate

>  <Mol_Weight> (BBL000812)
364.42

>  <Mol_Formula> (BBL000812)
C17H20N2O5S

>  <Smiles> (BBL000812)
CCOC(=O)C1CCCn2c1nc1sc(c(c1c2=O)C)C(=O)OCC

>  <Alternative_identifier> (BBL000812)
MFCD00377735

$$$$