COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL309542
Chemical Name: 1-cyclopentyl-4-(2,4-difluorophenyl)-7-hydroxy-1,2,4,6-tetrahydro-3H-pyrazolo[3,4-e][1,4]thiazepin-3-one
Smiles: Fc1ccc(c(c1)F)C1SCC(=Nc2c1c(=O)[nH]n2C1CCCC1)O

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Molecular Weight: 365.4
Empirical Formula: C17H17F2N3O2S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: 3.502
Rotatable bonds: 3
H-donors: 2
H-acceptors: 2
PSA: 90
Number of rings: 4

     

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