COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL409158
Chemical Name: 2-{3-[7-hydroxy-3-oxo-1-(tetrahydro-2H-thiopyran-4-yl)-2,3,4,6-tetrahydro-1H-pyrazolo[3,4-e][1,4]thiazepin-4-yl]phenoxy}acetamide
Smiles: NC(=O)COc1cccc(c1)C1SCC(=Nc2c1c(=O)[nH]n2C1CCSCC1)O

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Molecular Weight: 434.54
Empirical Formula: C19H22N4O4S2

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 1.496
Rotatable bonds: 6
H-donors: 4
H-acceptors: 4
PSA: 167
Number of rings: 4

     

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