COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL318077
Chemical Name: 1-(1,1-dioxidotetrahydrothiophen-3-yl)-3-methyl-4-(trifluoromethyl)-4,6-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7-ol
Smiles: OC1=Nc2c(C(SC1)C(F)(F)F)c(nn2C1CCS(=O)(=O)C1)C

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Molecular Weight: 369.39
Empirical Formula: C12H14F3N3O3S2

Physical State: Dry powder
Available Amount: 226 mg

Lipinsky:
logP: -0.365
Rotatable bonds: 2
H-donors: 1
H-acceptors: 3
PSA: 118
Number of rings: 3

     

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