COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL243975
Chemical Name: 1-(1,1-dioxidotetrahydrothiophen-3-yl)-4-(4-hydroxyphenyl)-3-methyl-4,6-dihydro-1H-pyrazolo[3,4-e][1,4]thiazepin-7-ol
Smiles: Oc1ccc(cc1)C1SCC(=Nc2c1c(C)nn2C1CCS(=O)(=O)C1)O

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Molecular Weight: 393.49
Empirical Formula: C17H19N3O4S2

Physical State: Dry powder
Available Amount: 150 mg

Lipinsky:
logP: -0.206
Rotatable bonds: 3
H-donors: 2
H-acceptors: 4
PSA: 138
Number of rings: 4

     

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