-ISIS-  08251614012D

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  2  5  2  0  0  0  0
 11 12  2  0  0  0  0
M  END
>  <ID> (STK000935)
STK000935

>  <Rotatable_Bonds> (STK000935)
5

>  <logP> (STK000935)
2.711

>  <PSA> (STK000935)
55.84

>  <H_Donors> (STK000935)
0

>  <H_Acceptors> (STK000935)
4

>  <Number_of_rings> (STK000935)
2

>  <NAME> (STK000935)
dimethyl 4-(3-bromo-4-fluorophenyl)-1-(propan-2-yl)-1,4-dihydropyridine-3,5-dicarboxylate

>  <Mol_Weight> (STK000935)
412.26

>  <Mol_Formula> (STK000935)
C18H19BrFNO4

>  <Smiles> (STK000935)
COC(=O)C1=CN(C=C(C1c1ccc(c(c1)Br)F)C(=O)OC)C(C)C

$$$$