COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK077442
Chemical Name: (6E)-6-{4-[2-(3-ethyl-5-methylphenoxy)ethoxy]-3-methoxybenzylidene}-5-imino-2-(2-methylpropyl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Smiles: CCc1cc(OCCOc2ccc(cc2OC)/C=C\2/C(=O)N=c3n(C2=N)nc(s3)CC(C)C)cc(c1)C

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Molecular Weight: 520.65
Empirical Formula: C28H32N4O4S

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 5.209
Rotatable bonds: 10
H-donors: 1
H-acceptors: 4
PSA: 121
Number of rings: 4

     

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