COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL245049
Chemical Name: 1-(1,1-dioxidotetrahydrothiophen-3-yl)-4-(4-fluorophenyl)-3-methyl-4,6-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7-ol
Smiles: Fc1ccc(cc1)C1SCC(=Nc2c1c(C)nn2C1CCS(=O)(=O)C1)O

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Molecular Weight: 395.48
Empirical Formula: C17H18FN3O3S2

Physical State: Dry powder
Available Amount: 312 mg

Lipinsky:
logP: 0.582
Rotatable bonds: 2
H-donors: 1
H-acceptors: 3
PSA: 118
Number of rings: 4

     

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