COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK830902
Chemical Name: 1-[(1,3-benzodioxol-5-ylmethyl)sulfanyl]-4,7,7-trimethyl-6,9-dihydro-7H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-5(4H)-one
Smiles: Cn1c2nnc(n2c2c(c1=O)c1CC(C)(C)OCc1s2)SCc1ccc2c(c1)OCO2

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Molecular Weight: 456.55
Empirical Formula: C21H20N4O4S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 4.54
Rotatable bonds: 3
H-donors: 0
H-acceptors: 4
PSA: 132
Number of rings: 6

     

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