COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL509677
Chemical Name: 3-{[(2-phenylethyl)sulfanyl]methyl}-6-[(E)-2-(3,4,5-trimethoxyphenyl)ethenyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Smiles: COc1cc(/C=C/c2nn3c(s2)nnc3CSCCc2ccccc2)cc(c1OC)OC

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Molecular Weight: 468.6
Empirical Formula: C23H24N4O3S2

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 5.742
Rotatable bonds: 7
H-donors: 0
H-acceptors: 3
PSA: 124
Number of rings: 4

     

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