COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK099722
Chemical Name: [(7,7-dimethyl-5-oxo-4-phenyl-4,5,6,9-tetrahydro-7H-pyrano[4',3':4,5]thieno[3,2-e][1,2,4]triazolo[4,3-a]pyrimidin-1-yl)sulfanyl]acetonitrile
Smiles: N#CCSc1nnc2n1c1sc3c(c1c(=O)n2c1ccccc1)CC(OC3)(C)C

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Molecular Weight: 423.52
Empirical Formula: C20H17N5O2S2

Physical State: Dry powder
Available Amount: 317 mg

Lipinsky:
logP: 4.13
Rotatable bonds: 2
H-donors: 0
H-acceptors: 2
PSA: 137
Number of rings: 5

     

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