COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL319904
Chemical Name: 7-hydroxy-4-[4-(2-methylpropoxy)phenyl]-1-(propan-2-yl)-1,2,4,6-tetrahydro-3H-pyrazolo[3,4-e][1,4]thiazepin-3-one
Smiles: CC(COc1ccc(cc1)C1SCC(=Nc2c1c(=O)[nH]n2C(C)C)O)C

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Molecular Weight: 375.49
Empirical Formula: C19H25N3O3S

Physical State: Dry powder
Available Amount: 323 mg

Lipinsky:
logP: 4.07
Rotatable bonds: 4
H-donors: 2
H-acceptors: 3
PSA: 99
Number of rings: 3

     

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