COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STL152837
Chemical Name: 3-{1-[4-(1,1-dioxidotetrahydrothiophen-3-yl)piperazin-1-yl]-1-oxopropan-2-yl}-1,2,3-benzotriazin-4(3H)-one
Smiles: O=C(C(n1nnc2c(c1=O)cccc2)C)N1CCN(CC1)C1CCS(=O)(=O)C1

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Molecular Weight: 405.48
Empirical Formula: C18H23N5O4S

Physical State: Dry powder
Available Amount: 302 mg

Lipinsky:
logP: -0.385
Rotatable bonds: 2
H-donors: 0
H-acceptors: 4
PSA: 111
Number of rings: 4

     

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