COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK007221
Chemical Name: (6Z)-6-{3-chloro-4-[2-(2,6-dimethylphenoxy)ethoxy]-5-ethoxybenzylidene}-5-imino-2-methyl-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Smiles: CCOc1cc(cc(c1OCCOc1c(C)cccc1C)Cl)/C=C/1\C(=O)N=c2n(C1=N)nc(s2)C

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Molecular Weight: 513.02
Empirical Formula: C25H25ClN4O4S

Physical State: Dry powder
Available Amount: 117 mg

Lipinsky:
logP: 4.586
Rotatable bonds: 7
H-donors: 1
H-acceptors: 4
PSA: 121
Number of rings: 4

     

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