COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK712803
Chemical Name: (6E)-2-(3,4-dimethoxybenzyl)-5-imino-6-[4-(methylsulfanyl)benzylidene]-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Smiles: CSc1ccc(cc1)/C=C\1/C(=O)N=c2n(C1=N)nc(s2)Cc1ccc(c(c1)OC)OC

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Molecular Weight: 452.56
Empirical Formula: C22H20N4O3S2

Physical State: Dry powder
Available Amount: 304 mg

Lipinsky:
logP: 2.844
Rotatable bonds: 4
H-donors: 1
H-acceptors: 3
PSA: 137
Number of rings: 4

     

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