COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL225091
Chemical Name: 2-chloro-4-{(E)-[2-(2-cyclohexylethyl)-5-imino-7-oxo-5H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-6(7H)-ylidene]methyl}phenylmethanesulfonate
Smiles: O=C1N=c2sc(nn2C(=N)/C/1=C\c1ccc(c(c1)Cl)OS(=O)(=O)C)CCC1CCCCC1

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Molecular Weight: 495.02
Empirical Formula: C21H23ClN4O4S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.566
Rotatable bonds: 6
H-donors: 1
H-acceptors: 4
PSA: 145
Number of rings: 4

     

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