COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK012805
Chemical Name: (6E)-6-{3-bromo-5-methoxy-4-[2-(3-methylphenoxy)ethoxy]benzylidene}-2-ethyl-5-imino-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Smiles: CCc1sc2=NC(=O)/C(=C/c3cc(Br)c(c(c3)OC)OCCOc3cccc(c3)C)/C(=N)n2n1

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Molecular Weight: 543.44
Empirical Formula: C24H23BrN4O4S

Physical State: Dry powder
Available Amount: 80 mg

Lipinsky:
logP: 4.092
Rotatable bonds: 8
H-donors: 1
H-acceptors: 4
PSA: 121
Number of rings: 4

     

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