COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK544098
Chemical Name: 3-[(1,3-benzodioxol-5-ylmethyl)sulfanyl]-10,10-dimethyl-5-(methylsulfanyl)-10,11-dihydro-8H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidine
Smiles: CSc1nc2sc3c(c2c2n1c(SCc1ccc4c(c1)OCO4)nn2)CC(OC3)(C)C

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Molecular Weight: 472.61
Empirical Formula: C21H20N4O3S3

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 6.803
Rotatable bonds: 4
H-donors: 0
H-acceptors: 3
PSA: 149
Number of rings: 6

     

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