COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK041648
Chemical Name: (6Z)-6-[4-(benzyloxy)-3-chloro-5-ethoxybenzylidene]-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(Cl)c(c(c3)OCC)OCc3ccccc3)/C(=N)n2n1

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Molecular Weight: 497.02
Empirical Formula: C25H25ClN4O3S

Physical State: Dry powder
Available Amount: 137 mg

Lipinsky:
logP: 5.239
Rotatable bonds: 8
H-donors: 1
H-acceptors: 3
PSA: 112
Number of rings: 4

     

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