COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL409935
Chemical Name: 7-hydroxy-4-(2-hydroxyquinolin-3-yl)-1-(tetrahydro-2H-pyran-4-yl)-1,2,4,6-tetrahydro-3H-pyrazolo[3,4-e][1,4]thiazepin-3-one
Smiles: OC1=Nc2c(C(SC1)c1cc3ccccc3nc1O)c(=O)[nH]n2C1CCOCC1

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Molecular Weight: 412.47
Empirical Formula: C20H20N4O4S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 1.756
Rotatable bonds: 4
H-donors: 3
H-acceptors: 4
PSA: 132
Number of rings: 5

     

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