COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK067128
Chemical Name: (6Z)-6-{3-bromo-5-ethoxy-4-[2-(2-methoxyphenoxy)ethoxy]benzylidene}-2-butyl-5-imino-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Smiles: CCCCc1sc2=NC(=O)/C(=C\c3cc(Br)c(c(c3)OCC)OCCOc3ccccc3OC)/C(=N)n2n1

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Molecular Weight: 601.52
Empirical Formula: C27H29BrN4O5S

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 5.047
Rotatable bonds: 12
H-donors: 1
H-acceptors: 5
PSA: 131
Number of rings: 4

     

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