COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION


Vitas-M Lab ID: STK996975
Chemical Name: (2E)-1-(5-methylthiophen-2-yl)-3-(4-nitrophenyl)prop-2-en-1-one
Smiles: O=C(c1ccc(s1)C)/C=C/c1ccc(cc1)[N+](=O)[O-]

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Molecular Weight: 273.31
Empirical Formula: C14H11NO3S

Physical State: Dry powder
Available Amount: 52 mg

Lipinsky:
logP: 3.855
Rotatable bonds: 2
H-donors: 0
H-acceptors: 3
PSA: 91
Number of rings: 2

     

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