COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK025769
Chemical Name: (6E)-2-benzyl-6-{4-[2-(3,4-dimethylphenoxy)ethoxy]-3,5-dimethoxybenzylidene}-5-imino-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Smiles: COc1cc(/C=C\2/C(=O)N=c3n(C2=N)nc(s3)Cc2ccccc2)cc(c1OCCOc1ccc(c(c1)C)C)OC

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Molecular Weight: 570.67
Empirical Formula: C31H30N4O5S

Physical State: Dry powder
Available Amount: 96 mg

Lipinsky:
logP: 4.806
Rotatable bonds: 7
H-donors: 1
H-acceptors: 5
PSA: 131
Number of rings: 5

     

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