COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK654692
Chemical Name: 3-[2-(3,4-dimethoxyphenyl)ethyl]-6-[(E)-2-phenylethenyl][1,2,4]triazolo[3,4-b][1,3,4]thiadiazole
Smiles: COc1cc(CCc2nnc3n2nc(s3)/C=C/c2ccccc2)ccc1OC

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Molecular Weight: 392.48
Empirical Formula: C21H20N4O2S

Physical State: Dry powder
Available Amount: 312 mg

Lipinsky:
logP: 5.185
Rotatable bonds: 6
H-donors: 0
H-acceptors: 2
PSA: 89
Number of rings: 4

     

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