COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK712823
Chemical Name: (6E)-5-imino-6-{4-[2-(2-methylphenoxy)ethoxy]benzylidene}-2-(pentan-3-yl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Smiles: CCC(c1nn2c(=NC(=O)/C(=C/c3ccc(cc3)OCCOc3ccccc3C)/C2=N)s1)CC

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Molecular Weight: 476.6
Empirical Formula: C26H28N4O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.867
Rotatable bonds: 7
H-donors: 1
H-acceptors: 3
PSA: 112
Number of rings: 4

     

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