COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK016618
Chemical Name: (6Z)-6-{4-[2-(3-ethyl-5-methylphenoxy)ethoxy]-3-methoxybenzylidene}-5-imino-2-(trifluoromethyl)-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)C(F)(F)F)cc(c1)C

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Molecular Weight: 532.54
Empirical Formula: C25H23F3N4O4S

Physical State: Dry powder
Available Amount: 400 mg

Lipinsky:
logP: 5.322
Rotatable bonds: 8
H-donors: 1
H-acceptors: 4
PSA: 121
Number of rings: 4

     

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