COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL154599
Chemical Name: 3-{4-[4-(1,1-dioxidotetrahydrothiophen-3-yl)piperazin-1-yl]-4-oxobutyl}-1,2,3-benzotriazin-4(3H)-one
Smiles: O=C(N1CCN(CC1)C1CCS(=O)(=O)C1)CCCn1nnc2c(c1=O)cccc2

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Molecular Weight: 419.5
Empirical Formula: C19H25N5O4S

Physical State: Dry powder
Available Amount: 300 mg

Lipinsky:
logP: -0.347
Rotatable bonds: 4
H-donors: 0
H-acceptors: 4
PSA: 111
Number of rings: 4

     

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