COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK024445
Chemical Name: (6E)-6-{3-bromo-4-[2-(4-bromophenoxy)ethoxy]-5-methoxybenzylidene}-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)OCCOc3ccc(cc3)Br)/C(=N)n2n1

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Molecular Weight: 608.31
Empirical Formula: C23H20Br2N4O4S

Physical State: Dry powder
Available Amount: 98 mg

Lipinsky:
logP: 4.663
Rotatable bonds: 7
H-donors: 1
H-acceptors: 4
PSA: 121
Number of rings: 4

     

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