COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK051058
Chemical Name: (6E)-2-benzyl-6-{3-ethoxy-4-[2-(4-methylphenoxy)ethoxy]benzylidene}-5-imino-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Smiles: CCOc1cc(ccc1OCCOc1ccc(cc1)C)/C=C\1/C(=O)N=c2n(C1=N)nc(s2)Cc1ccccc1

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Molecular Weight: 540.64
Empirical Formula: C30H28N4O4S

Physical State: Dry powder
Available Amount: 100 mg

Lipinsky:
logP: 5.115
Rotatable bonds: 8
H-donors: 1
H-acceptors: 4
PSA: 121
Number of rings: 5

     

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