COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL135276
Chemical Name: 4-[2-(3,4-dimethoxyphenyl)ethyl]-1-thioxo-2,4-dihydrothieno[2,3-e][1,2,4]triazolo[4,3-a]pyrimidin-5(1H)-one
Smiles: COc1cc(ccc1OC)CCn1c(=O)c2sccc2n2c1n[nH]c2=S

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Molecular Weight: 388.47
Empirical Formula: C17H16N4O3S2

Physical State: Dry powder
Available Amount: 165 mg

Lipinsky:
logP: 1.668
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 126
Number of rings: 4

     

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