COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK031276
Chemical Name: (6Z)-6-{4-[2-(4-tert-butylphenoxy)ethoxy]-3-ethoxybenzylidene}-5-imino-2-(trifluoromethyl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Smiles: CCOc1cc(ccc1OCCOc1ccc(cc1)C(C)(C)C)/C=C/1\C(=O)N=c2n(C1=N)nc(s2)C(F)(F)F

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Molecular Weight: 560.6
Empirical Formula: C27H27F3N4O4S

Physical State: Dry powder
Available Amount: 98 mg

Lipinsky:
logP: 6.09
Rotatable bonds: 7
H-donors: 1
H-acceptors: 4
PSA: 121
Number of rings: 4

     

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