COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL491047
Chemical Name: 4-tert-butyl-1-cyclohexyl-4,8-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepine-3,7(2H,6H)-dione
Smiles: O=C1CSC(c2c(N1)n([nH]c2=O)C1CCCCC1)C(C)(C)C

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Molecular Weight: 323.46
Empirical Formula: C16H25N3O2S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.659
Rotatable bonds: 1
H-donors: 2
H-acceptors: 2
PSA: 86
Number of rings: 3

     

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