COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK044768
Chemical Name: (2E)-3-(1,3-benzodioxol-5-yl)-N-(5-nitro-1,3-thiazol-2-yl)prop-2-enamide
Smiles: O=C(Nc1ncc(s1)[N+](=O)[O-])/C=C/c1ccc2c(c1)OCO2

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Molecular Weight: 319.3
Empirical Formula: C13H9N3O5S

Physical State: Dry powder
Available Amount: 495 mg

Lipinsky:
logP: 2.775
Rotatable bonds: 2
H-donors: 1
H-acceptors: 5
PSA: 134
Number of rings: 3

     

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