COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK828066
Chemical Name: (6Z)-6-(2-{2-[4-(butan-2-yl)phenoxy]ethoxy}-5-chlorobenzylidene)-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(Cl)ccc3OCCOc3ccc(cc3)C(CC)C)/C(=N)n2n1

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Molecular Weight: 511.04
Empirical Formula: C26H27ClN4O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.624
Rotatable bonds: 7
H-donors: 1
H-acceptors: 3
PSA: 112
Number of rings: 4

     

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