COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK712847
Chemical Name: (6E)-6-{4-[2-(2,4-dimethylphenoxy)ethoxy]benzylidene}-5-imino-2-(pentan-3-yl)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Smiles: CCC(c1sc2=NC(=O)/C(=C/c3ccc(cc3)OCCOc3ccc(cc3C)C)/C(=N)n2n1)CC

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Molecular Weight: 490.63
Empirical Formula: C27H30N4O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 5.327
Rotatable bonds: 7
H-donors: 1
H-acceptors: 3
PSA: 112
Number of rings: 4

     

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