COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL439607
Chemical Name: dimethyl(2Z)-2-[(5-amino-7-methyl[1,2,4]triazolo[4,3-c]pyrimidin-3-yl)sulfanyl]but-2-enedioate
Smiles: COC(=O)/C(=C/C(=O)OC)/Sc1nnc2n1c(N)nc(c2)C

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Molecular Weight: 323.33
Empirical Formula: C12H13N5O4S

Available Amount: 0 mg

Lipinsky:
logP: 0.764
Rotatable bonds: 6
H-donors: 2
H-acceptors: 4
PSA: 147
Number of rings: 2

     

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