COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK370917
Chemical Name: 5-[(2E)-2-(3-ethyl-1,3-benzothiazol-2(3H)-ylidene)ethylidene]-2,2-dimethyl-1,3-dioxane-4,6-dione
Smiles: CCn1/c(=C\C=C2C(=O)OC(OC2=O)(C)C)/sc2c1cccc2

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Molecular Weight: 331.39
Empirical Formula: C17H17NO4S

Physical State: Dry powder
Available Amount: 2 mg

Lipinsky:
logP: 0.674
Rotatable bonds: 2
H-donors: 0
H-acceptors: 4
PSA: 81
Number of rings: 3

     

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