COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL567071
Chemical Name: 2-{3-[1-(2,2-dimethyltetrahydro-2H-pyran-4-yl)-7-hydroxy-3-oxo-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]n2C1CCOC(C1)(C)C)O

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Molecular Weight: 446.53
Empirical Formula: C21H26N4O5S

Physical State: Dry powder
Available Amount: 50 mg

Lipinsky:
logP: 1.601
Rotatable bonds: 6
H-donors: 4
H-acceptors: 5
PSA: 151
Number of rings: 4

     

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