COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK968130
Chemical Name: (2E)-1-(3,4-dimethoxyphenyl)-3-(5-nitrothiophen-2-yl)prop-2-en-1-one
Smiles: COc1cc(ccc1OC)C(=O)/C=C/c1ccc(s1)[N+](=O)[O-]

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Molecular Weight: 319.34
Empirical Formula: C15H13NO5S

Available Amount: 0 mg

Lipinsky:
logP: 3.987
Rotatable bonds: 5
H-donors: 0
H-acceptors: 5
PSA: 109
Number of rings: 2

     

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