COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL410948
Chemical Name: 7-hydroxy-4-[4-(propan-2-yloxy)phenyl]-1-(tetrahydro-2H-pyran-4-yl)-1,2,4,6-tetrahydro-3H-pyrazolo[3,4-e][1,4]thiazepin-3-one
Smiles: CC(Oc1ccc(cc1)C1SCC(=Nc2c1c(=O)[nH]n2C1CCOCC1)O)C

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Molecular Weight: 403.5
Empirical Formula: C20H25N3O4S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 2.821
Rotatable bonds: 3
H-donors: 2
H-acceptors: 4
PSA: 108
Number of rings: 4

     

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