COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL491673
Chemical Name: 1-(2,2-dimethyltetrahydro-2H-pyran-4-yl)-4-(4-methoxyphenyl)-4,8-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepine-3,7(2H,6H)-dione
Smiles: COc1ccc(cc1)C1SCC(=O)Nc2c1c(=O)[nH]n2C1CCOC(C1)(C)C

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Molecular Weight: 403.5
Empirical Formula: C20H25N3O4S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.435
Rotatable bonds: 1
H-donors: 2
H-acceptors: 4
PSA: 105
Number of rings: 4

     

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