COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK836289
Chemical Name: 4-[(Z)-(5-imino-7-oxo-2-propyl-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6(7H)-ylidene)methyl]-2-methoxyphenylbenzenesulfonate
Smiles: CCCc1nn2c(=NC(=O)/C(=C\c3ccc(c(c3)OC)OS(=O)(=O)c3ccccc3)/C2=N)s1

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Molecular Weight: 484.56
Empirical Formula: C22H20N4O5S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.373
Rotatable bonds: 6
H-donors: 1
H-acceptors: 5
PSA: 155
Number of rings: 4

     

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