COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK712806
Chemical Name: (6E)-2-(3,4-dimethoxybenzyl)-5-imino-6-(naphthalen-1-ylmethylidene)-5,6-dihydro-7H-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one
Smiles: COc1cc(ccc1OC)Cc1nn2c(=NC(=O)/C(=C/c3cccc4c3cccc4)/C2=N)s1

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Molecular Weight: 456.52
Empirical Formula: C25H20N4O3S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.589
Rotatable bonds: 5
H-donors: 1
H-acceptors: 3
PSA: 112
Number of rings: 5

     

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